copper 6-azanyl-2-[(2-oxidanidyl-5-sulfo-phenyl)diazenyl]-3-sulfo-naphthalen-1-olate

Systemtic Name: copper 6-azanyl-2-[(2-oxidanidyl-5-sulfo-phenyl)diazenyl]-3-sulfo-naphthalen-1-olate Openeye Name: copper 6-amino-2-(2-oxido-5-sulfo-phenyl)azo-3-sulfo-naphthalen-1-olate CAS Name: copper 6-amino-2-(2-oxido-5-sulfophenyl)azo-3-sulfo-1-naphthalenolate IUPAC Name: copper 6-amino-2-[(2-oxido-5-sulfophenyl)diazenyl]-3-sulfonaphthalen-1-olate Traditional Name: cupric 6-amino-2-(2-oxido-5-sulfo-phenyl)azo-3-sulfo-naphthalen-1-olate Formula: C16H11CuN3O8S2 MolecularWeight: 500.94984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2C=C1N)S(=O)(=O)O)N=NC3=C(C=CC(=C3)S(=O)(=O)O)[O-])[O-].[Cu+2]

Isomeric SMILES

C1=CC2=C(C(=C(C=C2C=C1N)S(=O)(=O)O)N=NC3=C(C=CC(=C3)S(=O)(=O)O)[O-])[O-].[Cu+2]

InChI

InChI=1S/C16H13N3O8S2.Cu/c17-9-1-3-11-8(5-9)6-14(29(25,26)27)15(16(11)21)19-18-12-7-10(28(22,23)24)2-4-13(12)20;/h1-7,20-21H,17H2,(H,22,23,24)(H,25,26,27);/q;+2/p-2