1-(2-phenylethanoyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(2-phenylethanoyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(2-phenylacetyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(1-oxo-2-phenylethyl)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(2-phenylacetyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(2-phenylacetyl)-N-(4-pyrrolidinobenzyl)nipecotamide Formula: C25H31N3O2 MolecularWeight: 405.53254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)CNC(=O)C3CCCN(C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)CNC(=O)C3CCCN(C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2/c29-24(17-20-7-2-1-3-8-20)28-16-6-9-22(19-28)25(30)26-18-21-10-12-23(13-11-21)27-14-4-5-15-27/h1-3,7-8,10-13,22H,4-6,9,14-19H2,(H,26,30)