1-Naphthalenesulfonic acid, 6-amino-5-[(2-hydroxy-3,5-dinitrophenyl)azo]-, cobalt complex

84057-73-8

CAS Name

Cobaltate(3-), bis[6-amino-5-[(2-hydroxy-3,5-dinitrophenyl)azo]-1-naphthalenesulfonato(3-)]-, trisodium

Molecular Formula

C₃₂H₁₆CoN₁₀O₁₆S₂.3Na

Other Names and Identifiers

InChI

InChI=1S/2C16H10N5O8S.Co.3Na/c2*17-11-5-4-9-10(2-1-3-14(9)30(27,28)29)15(11)19-18-12-6-8(20(23)24)7-13(16(12)22)21(25)26;;;;/h2*1-7H,(H3-,17,18,19,22,27,28,29);;;;/q2*-1;+3;3*+1/p-4

InChIKey

InChIKey=GVOBRXRFJIWXKR-UHFFFAOYSA-J

SMILES

N(=O)(=O)C1=C2[O-][Co+3]345([N](C=6C([NH-]3)=CC=C7C6C=CC=C7S(=O)(=O)[O-])=NC=8C([O-]4)=C(N(=O)=O)C=C(N(=O)=O)C8)[N](C=9C([NH-]5)=CC=C%10C9C=CC=C%10S(=O)(=O)[O-])=NC2=CC(N(=O)=O)=C1.[Na+]

Canonical SMILES

[Na+].O=N(=O)C1=CC=2N=[N]3C=4C(=CC=C5C4C=CC=C5S(=O)(=O)[O-])[NH-][Co+3]673([O-]C2C(=C1)N(=O)=O)[O-]C8=C(N=[N]7C=9C(=CC=C%10C9C=CC=C%10S(=O)(=O)[O-])[NH-]6)C=C(C=C8N(=O)=O)N(=O)=O

Other Names for this Substance