copper; 5-azanyl-4-oxidanidyl-3-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]naphthalene-2,7-disulfonate; hydron

Systemtic Name: copper; 5-azanyl-4-oxidanidyl-3-[(2-oxidanidyl-5-sulfonato-phenyl)diazenyl]naphthalene-2,7-disulfonate; hydron Openeye Name: copper; 5-amino-4-oxido-3-(2-oxido-5-sulfonato-phenyl)azo-naphthalene-2,7-disulfonate; hydron CAS Name: copper; 5-amino-4-oxido-3-(2-oxido-5-sulfonatophenyl)azonaphthalene-2,7-disulfonate; hydron IUPAC Name: copper; 5-amino-4-oxido-3-[(2-oxido-5-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate; hydron Traditional Name: cupric; 5-amino-4-oxido-3-(2-oxido-5-sulfonato-phenyl)azo-naphthalene-2,7-disulfonate; hydron Formula: C16H11CuN3O11S3 MolecularWeight: 581.01304

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-])[O-].[Cu+2]

Isomeric SMILES

[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-])[O-].[Cu+2]

InChI

InChI=1S/C16H13N3O11S3.Cu/c17-10-5-9(32(25,26)27)3-7-4-13(33(28,29)30)15(16(21)14(7)10)19-18-11-6-8(31(22,23)24)1-2-12(11)20;/h1-6,20-21H,17H2,(H,22,23,24)(H,25,26,27)(H,28,29,30);/q;+2/p-2