ethyl 1-[(E)-2-(2-oxidanylidenepyridin-1-yl)-3-phenyl-prop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-2-(2-oxidanylidenepyridin-1-yl)-3-phenyl-prop-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-2-(2-oxo-1-pyridyl)-3-phenyl-prop-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-1-oxo-2-(2-oxo-1-pyridinyl)-3-phenylprop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-2-(2-oxopyridin-1-yl)-3-phenylprop-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-2-(2-keto-1-pyridyl)-3-phenyl-acryloyl]nipecotic acid ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C(=CC2=CC=CC=C2)N3C=CC=CC3=O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C(=C\C2=CC=CC=C2)/N3C=CC=CC3=O

InChI

InChI=1S/C22H24N2O4/c1-2-28-22(27)18-11-8-13-23(16-18)21(26)19(15-17-9-4-3-5-10-17)24-14-7-6-12-20(24)25/h3-7,9-10,12,14-15,18H,2,8,11,13,16H2,1H3/b19-15+