(2R)-N,N-dimethyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N,N-dimethyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N,N-dimethyl-2-[4-(o-tolyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N,N-dimethyl-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N,N-dimethyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N,N-dimethyl-2-[4-(o-tolyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O/c1-17-9-7-8-12-19(17)23-13-15-24(16-14-23)20(21(25)22(2)3)18-10-5-4-6-11-18/h4-12,20H,13-16H2,1-3H3/p+1/t20-/m1/s1