[4-[(E)-[(4-aminophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(E)-[(4-aminophenyl)carbonylhydrazinylidene]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[(E)-[(4-aminobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-[[(4-aminophenyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(4-aminobenzoyl)hydrazinylidene]methyl]-2-methoxyphenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(E)-[(4-aminobenzoyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC=C(C=C2)N)OC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)N)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H18N4O4/c1-28-19-11-14(12-24-25-20(26)15-5-7-17(22)8-6-15)4-9-18(19)29-21(27)16-3-2-10-23-13-16/h2-13H,22H2,1H3,(H,25,26)/b24-12+