N-(4-bromophenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-bromophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Formula: C16H21BrN3O2+ MolecularWeight: 367.26084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H20BrN3O2/c17-13-3-5-14(6-4-13)18-15(21)11-19-7-9-20(10-8-19)16(22)12-1-2-12/h3-6,12H,1-2,7-11H2,(H,18,21)/p+1