sodium; copper; 3-[(3,6-dimethyl-1-oxidanidyl-naphthalen-2-yl)diazenyl]-4-oxidanidyl-benzenesulfonate

Systemtic Name: sodium; copper; 3-[(3,6-dimethyl-1-oxidanidyl-naphthalen-2-yl)diazenyl]-4-oxidanidyl-benzenesulfonate Openeye Name: sodium; copper; 3-[(3,6-dimethyl-1-oxido-2-naphthyl)azo]-4-oxido-benzenesulfonate CAS Name: sodium; copper; 3-[(3,6-dimethyl-1-oxido-2-naphthalenyl)azo]-4-oxidobenzenesulfonate IUPAC Name: sodium; copper; 3-[(3,6-dimethyl-1-oxidonaphthalen-2-yl)diazenyl]-4-oxidobenzenesulfonate Traditional Name: sodium; copper; 3-[(3,6-dimethyl-1-oxido-2-naphthyl)azo]-4-oxido-besylate Formula: C18H13CuN2NaO5S-2 MolecularWeight: 455.90699

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C(=C2C=C1)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])[O-])C.[Na+].[Cu]

Isomeric SMILES

CC1=CC2=CC(=C(C(=C2C=C1)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])[O-])C.[Na+].[Cu]

InChI

InChI=1S/C18H16N2O5S.Cu.Na/c1-10-3-5-14-12(7-10)8-11(2)17(18(14)22)20-19-15-9-13(26(23,24)25)4-6-16(15)21;;/h3-9,21-22H,1-2H3,(H,23,24,25);;/q;;+1/p-3