chromium(3+); hydron; 3-oxidanidyl-4-[(2-oxidanidylnaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate

Systemtic Name: chromium(3+); hydron; 3-oxidanidyl-4-[(2-oxidanidylnaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate Openeye Name: chromic; hydron; 3-oxido-4-[(2-oxido-1-naphthyl)azo]naphthalene-1-sulfonate CAS Name: chromium(3+); hydron; 3-oxido-4-[(2-oxido-1-naphthalenyl)azo]-1-naphthalenesulfonate IUPAC Name: chromium(3+); hydron; 3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate Traditional Name: chromic; hydron; 3-oxido-4-[(2-oxido-1-naphthyl)azo]naphthalene-1-sulfonate Formula: C40H25CrN4O10S2 MolecularWeight: 837.7734

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].[Cr+3]

Isomeric SMILES

[H+].[H+].[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].[Cr+3]

InChI

InChI=1S/2C20H14N2O5S.Cr/c2*23-16-10-9-12-5-1-2-6-13(12)19(16)21-22-20-15-8-4-3-7-14(15)18(11-17(20)24)28(25,26)27;/h2*1-11,23-24H,(H,25,26,27);/q;;+3/p-3