3-bromanyl-N-[2-[4-(3-bromophenyl)carbonylpiperazin-1-ium-1-yl]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[4-(3-bromophenyl)carbonylpiperazin-1-ium-1-yl]ethyl]benzamide Openeye Name: 3-bromo-N-[2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]benzamide CAS Name: 3-bromo-N-[2-[4-[(3-bromophenyl)-oxomethyl]-1-piperazin-1-iumyl]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]benzamide Traditional Name: 3-bromo-N-[2-[4-(3-bromobenzoyl)piperazin-1-ium-1-yl]ethyl]benzamide Formula: C20H22Br2N3O2+ MolecularWeight: 496.21558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H21Br2N3O2/c21-17-5-1-3-15(13-17)19(26)23-7-8-24-9-11-25(12-10-24)20(27)16-4-2-6-18(22)14-16/h1-6,13-14H,7-12H2,(H,23,26)/p+1