[4-[(E)-3-oxidanylidene-3-pyridin-3-yl-prop-1-enyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(E)-3-oxidanylidene-3-pyridin-3-yl-prop-1-enyl]phenyl] pyridine-3-carboxylate Openeye Name: [4-[(E)-3-oxo-3-(3-pyridyl)prop-1-enyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-3-oxo-3-(3-pyridinyl)prop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-oxo-3-pyridin-3-ylprop-1-enyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(E)-3-keto-3-(3-pyridyl)prop-1-enyl]phenyl] ester Formula: C20H14N2O3 MolecularWeight: 330.33676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)C=CC2=CC=C(C=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H14N2O3/c23-19(16-3-1-11-21-13-16)10-7-15-5-8-18(9-6-15)25-20(24)17-4-2-12-22-14-17/h1-14H/b10-7+