1-(4-bromophenyl)sulfonyl-N-(4-methylpentyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(4-methylpentyl)piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-isohexyl-piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(4-methylpentyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(4-methylpentyl)piperidine-3-carboxamide Traditional Name: 1-brosyl-N-isohexyl-nipecotamide Formula: C18H27BrN2O3S MolecularWeight: 431.38758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CCCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H27BrN2O3S/c1-14(2)5-3-11-20-18(22)15-6-4-12-21(13-15)25(23,24)17-9-7-16(19)8-10-17/h7-10,14-15H,3-6,11-13H2,1-2H3,(H,20,22)