1-[(4-bromophenyl)methylsulfonyl]-N-butyl-piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methylsulfonyl]-N-butyl-piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-N-butyl-piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-N-butyl-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-N-butylpiperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)sulfonyl-N-butyl-isonipecotamide Formula: C17H25BrN2O3S MolecularWeight: 417.361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H25BrN2O3S/c1-2-3-10-19-17(21)15-8-11-20(12-9-15)24(22,23)13-14-4-6-16(18)7-5-14/h4-7,15H,2-3,8-13H2,1H3,(H,19,21)