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

Systemtic Name: 2-methoxy-4-[(Z)-[(4-methylphenyl)carbamothioylhydrazinylidene]methyl]-6-nitro-phenolate Openeye Name: 2-methoxy-6-nitro-4-[(Z)-(p-tolylcarbamothioylhydrazono)methyl]phenolate CAS Name: 2-methoxy-4-[(Z)-[[(4-methylanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 2-methoxy-4-[(Z)-[(4-methylphenyl)carbamothioylhydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 2-methoxy-6-nitro-4-[(Z)-(p-tolylthiocarbamoylhydrazono)methyl]phenolate Formula: C16H15N4O4S- MolecularWeight: 359.3797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NN=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N/N=C\C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/c1-10-3-5-12(6-4-10)18-16(25)19-17-9-11-7-13(20(22)23)15(21)14(8-11)24-2/h3-9,21H,1-2H3,(H2,18,19,25)/p-1/b17-9-