Ethanol, 2,2′-(dodecylimino)bis-, bis[2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoato(2-)]chromate(1-)

84215-37-2

CAS Name

Chromate(1-), bis[2-[2-[4,5-dihydro-3-methyl-5-(oxo-κO)-1-phenyl-1H-pyrazol-4-yl]diazenyl-κN¹]benzoato(2-)-κO]-, hydrogen, compd. with 2,2′-(dodecylimino)bis[ethanol] (1:1:1)

Molecular Formula

C₃₄H₂₄CrN₈O₆.C₁₆H₃₅NO₂.H

Other Names and Identifiers

InChI

InChI=1S/2C17H13N4O3.C16H35NO2.Cr/c2*1-11-15(16(22)21(20-11)12-7-3-2-4-8-12)19-18-14-10-6-5-9-13(14)17(23)24;1-2-3-4-5-6-7-8-9-10-11-12-17(13-15-18)14-16-19;/h2*2-10H,1H3,(H,23,24);18-19H,2-16H2,1H3;/q2*-1;;+3/p-1

InChIKey

InChIKey=ZMGCPYNTNYFJTI-UHFFFAOYSA-M

SMILES

O=C1[O-][Cr+3]234([N](C=5C(C(=O)[O-]2)=CC=CC5)=N[C-]6C(=O3)N(N=C6C)C7=CC=CC=C7)[N](C=8C1=CC=CC8)=N[C-]9C(=O4)N(N=C9C)C%10=CC=CC=C%10.[H+].N(CCCCCCCCCCCC)(CCO)CCO

Canonical SMILES

[H+].O=C1[O-][Cr+3]234(O=C5[C-](N=[N]2C=6C=CC=CC16)C(=NN5C=7C=CC=CC7)C)O=C8[C-](N=[N]4C=9C=CC=CC9C(=O)[O-]3)C(=NN8C=%10C=CC=CC%10)C.OCCN(CCO)CCCCCCCCCCCC

Other Names for this Substance