N-(4-methylphenyl)-2-[4-[4-(4-methylphenyl)-4-oxidanylidene-butanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[4-(4-methylphenyl)-4-oxidanylidene-butanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[4-oxo-4-(p-tolyl)butanoyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[4-(4-methylphenyl)-1,4-dioxobutyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[4-(4-methylphenyl)-4-oxobutanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[4-keto-4-(p-tolyl)butanoyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C24H29N3O3/c1-18-3-7-20(8-4-18)22(28)11-12-24(30)27-15-13-26(14-16-27)17-23(29)25-21-9-5-19(2)6-10-21/h3-10H,11-17H2,1-2H3,(H,25,29)/p+1