[4-(2-ethoxycarbonyl-3-oxidanylidene-but-1-enyl)phenyl] pyridine-4-carboxylate

Systemtic Name: [4-(2-ethoxycarbonyl-3-oxidanylidene-but-1-enyl)phenyl] pyridine-4-carboxylate Openeye Name: [4-(2-ethoxycarbonyl-3-oxo-but-1-enyl)phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-(2-ethoxycarbonyl-3-oxobut-1-enyl)phenyl] ester IUPAC Name: [4-(2-ethoxycarbonyl-3-oxobut-1-enyl)phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-(2-carbethoxy-3-keto-but-1-enyl)phenyl] ester Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=NC=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=NC=C2)C(=O)C

InChI

InChI=1S/C19H17NO5/c1-3-24-19(23)17(13(2)21)12-14-4-6-16(7-5-14)25-18(22)15-8-10-20-11-9-15/h4-12H,3H2,1-2H3