Benzenesulfonic acid, 2-hydroxy-5-nitro-3-[[2-oxo-1-[(phenylamino)carbonyl]propyl]azo]-, chromium complex

CAS Name

Xanthylium, 9-(2-carboxyphenyl)-3,6-bis(diethylamino)-, bis[2-(hydroxy-κO)-5-nitro-3-[2-[2-(oxo-κO)-1-[(phenylamino)carbonyl]propyl]diazenyl-κN¹]benzenesulfonato(3-)]chromate(3-) (3:1)

Molecular Formula

C₃₂H₂₂CrN₈O₁₆S₂.3C₂₈H₃₁N₂O₃

Molecular Mass

2221.37

Other Names and Identifiers

InChI

InChI=1S/C28H30N2O3.2C16H13N4O8S.Cr/c1-5-29(6-2)19-13-15-23-25(17-19)33-26-18-20(30(7-3)8-4)14-16-24(26)27(23)21-11-9-10-12-22(21)28(31)32;2*1-9(21)14(16(23)17-10-5-3-2-4-6-10)19-18-12-7-11(20(24)25)8-13(15(12)22)29(26,27)28;/h9-18H,5-8H2,1-4H3;2*2-8,22H,1H3,(H,17,23)(H,26,27,28);/q;2*-1;+3/p-3

InChIKey

InChIKey=DVYYHEVZEKPBCL-UHFFFAOYSA-K

Canonical SMILES

O=C(O)C=1C=CC=CC1C=2C=3C=CC(=CC3[O+]=C4C=C(C=CC42)N(CC)CC)N(CC)CC.O=C(NC=1C=CC=CC1)[C-]2N=[N]3C=4C=C(C=C(C4[O-][Cr+3]563(O=C2C)O=C([C-](N=[N]6C=7C=C(C=C(C7[O-]5)S(=O)(=O)[O-])N(=O)=O)C(=O)NC=8C=CC=CC8)C)S(=O)(=O)[O-])N(=O)=O

Other Names for this Substance