4-chloranyl-2-[(Z)-[(4-methoxyphenyl)methylcarbamothioylhydrazinylidene]methyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(Z)-[(4-methoxyphenyl)methylcarbamothioylhydrazinylidene]methyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(Z)-[(4-methoxyphenyl)methylcarbamothioylhydrazono]methyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(Z)-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(Z)-[(4-methoxyphenyl)methylcarbamothioylhydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 4-chloro-2-nitro-6-[(Z)-(p-anisylthiocarbamoylhydrazono)methyl]phenolate Formula: C16H14ClN4O4S- MolecularWeight: 393.82476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN4O4S/c1-25-13-4-2-10(3-5-13)8-18-16(26)20-19-9-11-6-12(17)7-14(15(11)22)21(23)24/h2-7,9,22H,8H2,1H3,(H2,18,20,26)/p-1/b19-9-