copper; hydron; 3-oxidanidyl-4-phenyldiazenyl-naphthalene-2-carboxylate

Systemtic Name: copper; hydron; 3-oxidanidyl-4-phenyldiazenyl-naphthalene-2-carboxylate Openeye Name: copper; hydron; 3-oxido-4-phenylazo-naphthalene-2-carboxylate CAS Name: copper; hydron; 3-oxido-4-phenyldiazenyl-2-naphthalenecarboxylate IUPAC Name: copper; hydron; 3-oxido-4-phenyldiazenylnaphthalene-2-carboxylate Traditional Name: cupric; hydron; 3-oxido-4-phenylazo-2-naphthoate Formula: C34H22CuN4O6 MolecularWeight: 646.10768

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].C1=CC=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-].C1=CC=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-].[Cu+2]

Isomeric SMILES

[H+].[H+].C1=CC=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-].C1=CC=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-].[Cu+2]

InChI

InChI=1S/2C17H12N2O3.Cu/c2*20-16-14(17(21)22)10-11-6-4-5-9-13(11)15(16)19-18-12-7-2-1-3-8-12;/h2*1-10,20H,(H,21,22);/q;;+2/p-2