N-(3-bromophenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(3-bromophenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(3-bromophenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(3-bromophenyl)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(3-bromophenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-(3-bromophenyl)-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C19H23BrN3O+ MolecularWeight: 389.30942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)Br)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C19H22BrN3O/c20-16-5-4-6-17(15-16)21-19(24)9-10-22-11-13-23(14-12-22)18-7-2-1-3-8-18/h1-8,15H,9-14H2,(H,21,24)/p+1