2-methoxy-6-nitro-4-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenolate Openeye Name: 4-[(Z)-(benzylcarbamothioylhydrazono)methyl]-2-methoxy-6-nitro-phenolate CAS Name: 2-methoxy-6-nitro-4-[(Z)-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenolate IUPAC Name: 4-[(Z)-(benzylcarbamothioylhydrazinylidene)methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-(benzylthiocarbamoylhydrazono)methyl]-2-methoxy-6-nitro-phenolate Formula: C16H15N4O4S- MolecularWeight: 359.3797

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=NNC(=S)NCC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=N\NC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H16N4O4S/c1-24-14-8-12(7-13(15(14)21)20(22)23)10-18-19-16(25)17-9-11-5-3-2-4-6-11/h2-8,10,21H,9H2,1H3,(H2,17,19,25)/p-1/b18-10-