[4-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-methoxy-phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-methoxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[(E)-(1H-benzimidazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-methoxyphenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(E)-(1H-benzimidazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=NC3=CC=CC=C3N2)OC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=NC3=CC=CC=C3N2)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H17N5O3/c1-28-19-11-14(8-9-18(19)29-20(27)15-5-4-10-22-13-15)12-23-26-21-24-16-6-2-3-7-17(16)25-21/h2-13H,1H3,(H2,24,25,26)/b23-12+