1-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylcarbonylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylcarbonylphenyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-besyl-N-[3-(pyrrolidine-1-carbonyl)phenyl]nipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S/c27-22(24-20-10-6-8-18(16-20)23(28)25-13-4-5-14-25)19-9-7-15-26(17-19)31(29,30)21-11-2-1-3-12-21/h1-3,6,8,10-12,16,19H,4-5,7,9,13-15,17H2,(H,24,27)