ethyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-3-(4-cyanophenyl)acryloyl]nipecotic acid ethyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H20N2O3/c1-2-23-18(22)16-4-3-11-20(13-16)17(21)10-9-14-5-7-15(12-19)8-6-14/h5-10,16H,2-4,11,13H2,1H3/b10-9+