2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-[4-(o-tolyl)piperazin-1-ium-1-yl]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C24H34N4O+2 MolecularWeight: 394.55296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C[NH+]4CCCC4

InChI

InChI=1S/C24H32N4O/c1-20-6-2-3-7-23(20)28-16-14-27(15-17-28)19-24(29)25-22-10-8-21(9-11-22)18-26-12-4-5-13-26/h2-3,6-11H,4-5,12-19H2,1H3,(H,25,29)/p+2