1-(4-bromophenyl)carbonyl-N-[(2S)-5-methylhexan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-[(2S)-5-methylhexan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-[(1S)-1,4-dimethylpentyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[(2S)-5-methylhexan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-[(2S)-5-methylhexan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[(1S)-1,4-dimethylpentyl]isonipecotamide Formula: C20H29BrN2O2 MolecularWeight: 409.36046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H29BrN2O2/c1-14(2)4-5-15(3)22-19(24)16-10-12-23(13-11-16)20(25)17-6-8-18(21)9-7-17/h6-9,14-16H,4-5,10-13H2,1-3H3,(H,22,24)/t15-/m0/s1