[4-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl] pyridine-2-carboxylate

Systemtic Name: [4-[(E)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]phenyl] pyridine-2-carboxylate Openeye Name: [4-[(E)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]phenyl] pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate Traditional Name: picolinic acid [4-[(E)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]phenyl] ester Formula: C18H14N2O4 MolecularWeight: 322.31476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=CC=N2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)OC(=O)C2=CC=CC=N2)/C#N

InChI

InChI=1S/C18H14N2O4/c1-2-23-17(21)14(12-19)11-13-6-8-15(9-7-13)24-18(22)16-5-3-4-10-20-16/h3-11H,2H2,1H3/b14-11+