methyl 1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[(1R)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(1R)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H26N2O3/c1-16(24-14-12-18(13-15-24)22(26)27-2)21(25)23-20-11-7-6-10-19(20)17-8-4-3-5-9-17/h3-11,16,18H,12-15H2,1-2H3,(H,23,25)/p+1/t16-/m1/s1