N-[2,6-di(propan-2-yl)phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-diisopropylphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-diisopropylphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C25H36N3O+ MolecularWeight: 394.57284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C(C)C)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC3=C(C=CC=C3C(C)C)C(C)C

InChI

InChI=1S/C25H35N3O/c1-18(2)21-10-8-11-22(19(3)4)25(21)26-24(29)17-27-13-15-28(16-14-27)23-12-7-6-9-20(23)5/h6-12,18-19H,13-17H2,1-5H3,(H,26,29)/p+1