2-[4-(3-bromophenyl)carbonylpiperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(3-bromophenyl)carbonylpiperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(3-bromophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C16H23BrN3O2+ MolecularWeight: 369.27672

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H22BrN3O2/c1-2-6-18-15(21)12-19-7-9-20(10-8-19)16(22)13-4-3-5-14(17)11-13/h3-5,11H,2,6-10,12H2,1H3,(H,18,21)/p+1