[2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-methoxy-4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenyl] ester Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2C=NN=C2C3=CC=CC=C3)OC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\N2C=NN=C2C3=CC=CC=C3)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H17N5O3/c1-29-20-12-16(9-10-19(20)30-22(28)18-8-5-11-23-14-18)13-25-27-15-24-26-21(27)17-6-3-2-4-7-17/h2-15H,1H3/b25-13-