N-[(4-dimethylaminophenyl)methyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[4-(dimethylamino)benzyl]-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C22H31N4O+ MolecularWeight: 367.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H30N4O/c1-18-6-4-5-7-21(18)26-14-12-25(13-15-26)17-22(27)23-16-19-8-10-20(11-9-19)24(2)3/h4-11H,12-17H2,1-3H3,(H,23,27)/p+1