4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazono]methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-[[[(4-fluorophenyl)methylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-[(4-fluorophenyl)methylcarbamothioylhydrazinylidene]methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-[(4-fluorobenzyl)thiocarbamoylhydrazono]methyl]-2-methoxy-6-nitro-phenolate Formula: C16H14FN4O4S- MolecularWeight: 377.370163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15FN4O4S/c1-25-14-7-11(6-13(15(14)22)21(23)24)9-19-20-16(26)18-8-10-2-4-12(17)5-3-10/h2-7,9,22H,8H2,1H3,(H2,18,20,26)/p-1/b19-9-