N-(2,3-dimethylphenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-[3-(p-tolyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[4-[3-(4-methylphenyl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-[3-(4-methylphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[4-[3-(p-tolyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C24H31N3O2/c1-18-7-9-21(10-8-18)11-12-24(29)27-15-13-26(14-16-27)17-23(28)25-22-6-4-5-19(2)20(22)3/h4-10H,11-17H2,1-3H3,(H,25,28)/p+1