copper; 6-[ethenylsulfonyl(methyl)amino]-4-oxidanidyl-3-[(1-oxidanidyl-5-sulfonato-naphthalen-2-yl)diazenyl]naphthalene-2-sulfonate; hydron

Systemtic Name: copper; 6-[ethenylsulfonyl(methyl)amino]-4-oxidanidyl-3-[(1-oxidanidyl-5-sulfonato-naphthalen-2-yl)diazenyl]naphthalene-2-sulfonate; hydron Openeye Name: copper; hydron; 6-[methyl(vinylsulfonyl)amino]-4-oxido-3-[(1-oxido-5-sulfonato-2-naphthyl)azo]naphthalene-2-sulfonate CAS Name: copper; 6-[ethenylsulfonyl(methyl)amino]-4-oxido-3-[(1-oxido-5-sulfonato-2-naphthalenyl)azo]-2-naphthalenesulfonate; hydron IUPAC Name: copper; 6-[ethenylsulfonyl(methyl)amino]-4-oxido-3-[(1-oxido-5-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonate; hydron Traditional Name: cupric; hydron; 6-[methyl(vinylsulfonyl)amino]-4-oxido-3-[(1-oxido-5-sulfonato-2-naphthyl)azo]naphthalene-2-sulfonate Formula: C23H17CuN3O10S3 MolecularWeight: 655.13618

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].CN(C1=CC2=C(C(=C(C=C2C=C1)S(=O)(=O)[O-])N=NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)C=C.[Cu+2]

Isomeric SMILES

[H+].[H+].CN(C1=CC2=C(C(=C(C=C2C=C1)S(=O)(=O)[O-])N=NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)C=C.[Cu+2]

InChI

InChI=1S/C23H19N3O10S3.Cu/c1-3-37(29,30)26(2)14-8-7-13-11-20(39(34,35)36)21(23(28)17(13)12-14)25-24-18-10-9-15-16(22(18)27)5-4-6-19(15)38(31,32)33;/h3-12,27-28H,1H2,2H3,(H,31,32,33)(H,34,35,36);/q;+2/p-2