(2R)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)propanamide

Systemtic Name: (2R)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)propanamide Openeye Name: (2R)-N-(2-isopropyl-6-methyl-phenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-N-(2-methyl-6-propan-2-ylphenyl)propanamide IUPAC Name: (2R)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)propanamide Traditional Name: (2R)-N-(2-isopropyl-6-methyl-phenyl)-2-[4-(o-tolyl)piperazin-1-ium-1-yl]propionamide Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C(C)[NH+]2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)[C@@H](C)[NH+]2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C24H33N3O/c1-17(2)21-11-8-10-19(4)23(21)25-24(28)20(5)26-13-15-27(16-14-26)22-12-7-6-9-18(22)3/h6-12,17,20H,13-16H2,1-5H3,(H,25,28)/p+1/t20-/m1/s1