ethyl 1-[4-(pyrrolidin-1-ylmethyl)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(pyrrolidin-1-ylmethyl)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-(pyrrolidin-1-ylmethyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[4-(1-pyrrolidinylmethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(pyrrolidin-1-ylmethyl)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(pyrrolidinomethyl)benzoyl]isonipecotic acid ethyl ester Formula: C20H28N2O3 MolecularWeight: 344.44792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C20H28N2O3/c1-2-25-20(24)18-9-13-22(14-10-18)19(23)17-7-5-16(6-8-17)15-21-11-3-4-12-21/h5-8,18H,2-4,9-15H2,1H3