N-methyl-1-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-1-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-1-[(1R)-1-methyl-2-oxo-2-(p-tolylmethylamino)ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[(2R)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1R)-2-keto-1-methyl-2-[(4-methylbenzyl)amino]ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)[NH+]2CCC(CC2)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@@H](C)[NH+]2CCC(CC2)C(=O)NC

InChI

InChI=1S/C18H27N3O2/c1-13-4-6-15(7-5-13)12-20-17(22)14(2)21-10-8-16(9-11-21)18(23)19-3/h4-7,14,16H,8-12H2,1-3H3,(H,19,23)(H,20,22)/p+1/t14-/m1/s1