magnesium 3-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate

Systemtic Name: magnesium 3-[(2Z)-2-(2-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate Openeye Name: magnesium 3-[(2Z)-2-(2-oxo-1-naphthylidene)hydrazino]naphthalene-2-sulfonate CAS Name: magnesium 3-[(2Z)-2-(2-oxo-1-naphthalenylidene)hydrazinyl]-2-naphthalenesulfonate IUPAC Name: magnesium 3-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate Traditional Name: magnesium 3-[(N'Z)-N'-(2-keto-1-naphthylidene)hydrazino]naphthalene-2-sulfonate Formula: C40H26MgN4O8S2 MolecularWeight: 779.09144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-].[Mg+2]

Isomeric SMILES

C1=CC=C2/C(=N/NC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-])/C(=O)C=CC2=C1.C1=CC=C2/C(=N/NC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-])/C(=O)C=CC2=C1.[Mg+2]

InChI

InChI=1S/2C20H14N2O4S.Mg/c2*23-18-10-9-13-5-3-4-8-16(13)20(18)22-21-17-11-14-6-1-2-7-15(14)12-19(17)27(24,25)26;/h2*1-12,21H,(H,24,25,26);/q;;+2/p-2/b2*22-20-;