1-[(3-bromophenyl)methyl]-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-[4-methyl-3-(2-oxo-1-pyrrolidinyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-[3-(2-ketopyrrolidino)-4-methyl-phenyl]nipecotamide Formula: C24H28BrN3O2 MolecularWeight: 470.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)CC3=CC(=CC=C3)Br)N4CCCC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)CC3=CC(=CC=C3)Br)N4CCCC4=O

InChI

InChI=1S/C24H28BrN3O2/c1-17-9-10-21(14-22(17)28-12-4-8-23(28)29)26-24(30)19-6-3-11-27(16-19)15-18-5-2-7-20(25)13-18/h2,5,7,9-10,13-14,19H,3-4,6,8,11-12,15-16H2,1H3,(H,26,30)