(2R)-N-(3-ethanoylphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(3-ethanoylphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(3-acetylphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(3-acetylphenyl)-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(3-acetylphenyl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(3-acetylphenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propionamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)C(C)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H27N3O2/c1-16-7-4-5-10-21(16)25-13-11-24(12-14-25)17(2)22(27)23-20-9-6-8-19(15-20)18(3)26/h4-10,15,17H,11-14H2,1-3H3,(H,23,27)/p+1/t17-/m1/s1