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

Systemtic Name: ethyl 1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)C(C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)[C@H](C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c1-3-28-23(27)19-13-15-25(16-14-19)17(2)22(26)24-21-12-8-7-11-20(21)18-9-5-4-6-10-18/h4-12,17,19H,3,13-16H2,1-2H3,(H,24,26)/p+1/t17-/m1/s1