1-(4-bromophenyl)carbonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]isonipecotamide Formula: C22H33BrN3O2+ MolecularWeight: 451.42032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H32BrN3O2/c1-17-7-13-25(14-8-17)12-2-11-24-21(27)18-9-15-26(16-10-18)22(28)19-3-5-20(23)6-4-19/h3-6,17-18H,2,7-16H2,1H3,(H,24,27)/p+1