N-(3-bromophenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-(3-bromophenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(3-bromophenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(3-bromophenyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(3-bromophenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(3-bromophenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C14H22BrN3O+2 MolecularWeight: 328.24798

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H20BrN3O/c1-17-7-9-18(10-8-17)6-5-14(19)16-13-4-2-3-12(15)11-13/h2-4,11H,5-10H2,1H3,(H,16,19)/p+2