(2R)-N-methyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(phenylmethyl)propanamide

Systemtic Name: (2R)-N-methyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-N-methyl-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-methyl-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-N-methyl-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-benzyl-N-methyl-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propionamide Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)C(C)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O/c1-18-9-7-8-12-21(18)25-15-13-24(14-16-25)19(2)22(26)23(3)17-20-10-5-4-6-11-20/h4-12,19H,13-17H2,1-3H3/p+1/t19-/m1/s1