1-[(2R)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2R)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1R)-2-(2,5-dimethylanilino)-1-methyl-2-oxo-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2R)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2R)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1R)-2-(2,5-dimethylanilino)-2-keto-1-methyl-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)C)NC(=O)C(C)[NH+]2CCC(CC2)C(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2/c1-12-5-6-13(2)16(11-12)20-17(22)14(3)21-9-7-15(8-10-21)18(23)19-4/h5-6,11,14-15H,7-10H2,1-4H3,(H,19,23)(H,20,22)/p+1/t14-/m1/s1