ethyl 1-[3-(chloromethyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(chloromethyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-(chloromethyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-(chloromethyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(chloromethyl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(chloromethyl)benzoyl]isonipecotic acid ethyl ester Formula: C16H20ClNO3 MolecularWeight: 309.7879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)CCl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)CCl

InChI

InChI=1S/C16H20ClNO3/c1-2-21-16(20)13-6-8-18(9-7-13)15(19)14-5-3-4-12(10-14)11-17/h3-5,10,13H,2,6-9,11H2,1H3