CAS Registry Number®
83733-23-7
CAS Name
Chromate(2-), [3-[2-[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]diazenyl-κN1]-4-(hydroxy-κO)-5-nitrobenzenesulfonato(3-)][2-[[[2-(hydroxy-κO)phenyl]methylene]amino-κN]-4-nitrophenolato(2-)-κO]-, sodium (1:2)
Molecular Formula
C29H18CrN7O11S.2Na
Other Names and Identifiers
InChI
InChI=1S/C16H12N5O7S.C13H10N2O4.Cr.2Na/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(29(26,27)28)8-13(15(12)22)21(24)25;16-12-4-2-1-3-9(12)8-14-11-7-10(15(18)19)5-6-13(11)17;;;/h2-8,22H,1H3,(H,26,27,28);1-8,16-17H;;;/q-1;;+3;2*+1/p-4
InChIKey
InChIKey=POFMDTUHACUYJU-UHFFFAOYSA-J
SMILES
N(=O)(=O)C1=C2[O-][Cr+3]345([N](C2=CC(S(=O)(=O)[O-])=C1)=N[C-]6C(=O3)N(N=C6C)C7=CC=CC=C7)[N](C=8C([O-]4)=CC=C(N(=O)=O)C8)=CC=9C([O-]5)=CC=CC9.[Na+]
Canonical SMILES
[Na+].O=N(=O)C=1C=CC=2[O-][Cr+3]345(O=C6[C-](N=[N]4C=7C=C(C=C(C7[O-]3)N(=O)=O)S(=O)(=O)[O-])C(=NN6C=8C=CC=CC8)C)[O-]C=9C=CC=CC9C=[N]5C2C1
Other Names for this Substance
- Chromate(2-), [3-[2-[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]diazenyl-κN1]-4-(hydroxy-κO)-5-nitrobenzenesulfonato(3-)][2-[[[2-(hydroxy-κO)phenyl]methylene]amino-κN]-4-nitrophenolato(2-)-κO]-, sodium (1:2)
- Chromate(2-), [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-5-nitrobenzenesulfonato(3-)][2-[[(2-hydroxyphenyl)methylene]amino]-4-nitrophenolato(2-)-N2,O1,O2]-, disodium
- Chromate(2-), [3-[[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]azo-κN1]-4-(hydroxy-κO)-5-nitrobenzenesulfonato(3-)][2-[[[2-(hydroxy-κO)phenyl]methylene]amino-κN]-4-nitrophenolato(2-)-κO]-, disodium
- Benzenesulfonic acid, 3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-5-nitro-, chromium complex
- Phenol, 2-[[(2-hydroxyphenyl)methylene]amino]-4-nitro-, chromium complex