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

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-(m-tolylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[4-[(3-methylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-(3-methylbenzyl)piperazin-1-ium-1-yl]acetamide Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC(=O)NC(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC(=O)NC(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H30N4O2/c1-17-5-4-6-20(14-17)15-26-9-11-27(12-10-26)16-22(28)25-23(29)24-21-8-7-18(2)13-19(21)3/h4-8,13-14H,9-12,15-16H2,1-3H3,(H2,24,25,28,29)/p+1