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

Systemtic Name: (2R)-N-(2-methoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2-methoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2-methoxyphenyl)-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2-methoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2-methoxyphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propionamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)C(C)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C21H27N3O2/c1-16-8-4-6-10-19(16)24-14-12-23(13-15-24)17(2)21(25)22-18-9-5-7-11-20(18)26-3/h4-11,17H,12-15H2,1-3H3,(H,22,25)/p+1/t17-/m1/s1