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

Systemtic Name: 1-[(2R)-1-[(2-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1R)-2-[(2-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2R)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1R)-2-[(2-chlorobenzyl)amino]-2-keto-1-methyl-ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C17H25ClN3O2+ MolecularWeight: 338.8523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)[NH+]2CCC(CC2)C(=O)NC

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1Cl)[NH+]2CCC(CC2)C(=O)NC

InChI

InChI=1S/C17H24ClN3O2/c1-12(21-9-7-13(8-10-21)17(23)19-2)16(22)20-11-14-5-3-4-6-15(14)18/h3-6,12-13H,7-11H2,1-2H3,(H,19,23)(H,20,22)/p+1/t12-/m1/s1