[2-[3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] pyridine-4-carboxylate

Systemtic Name: [2-[3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]phenyl] pyridine-4-carboxylate Openeye Name: [2-[3-(4-chlorophenyl)-3-oxo-prop-1-enyl]phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [2-[3-(4-chlorophenyl)-3-oxoprop-1-enyl]phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-[3-(4-chlorophenyl)-3-keto-prop-1-enyl]phenyl] ester Formula: C21H14ClNO3 MolecularWeight: 363.79376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)Cl)OC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)Cl)OC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H14ClNO3/c22-18-8-5-15(6-9-18)19(24)10-7-16-3-1-2-4-20(16)26-21(25)17-11-13-23-14-12-17/h1-14H