1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-[1-(4-methoxyphenyl)propyl]isonipecotamide Formula: C23H29BrN2O4S MolecularWeight: 509.45636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H29BrN2O4S/c1-3-22(18-7-9-21(30-2)10-8-18)25-23(27)19-11-13-26(14-12-19)31(28,29)16-17-5-4-6-20(24)15-17/h4-10,15,19,22H,3,11-14,16H2,1-2H3,(H,25,27)