1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1R)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1R)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C27H30N3O2+ MolecularWeight: 428.546

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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)NC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-20(26(31)29-25-15-9-8-14-24(25)21-10-4-2-5-11-21)30-18-16-22(17-19-30)27(32)28-23-12-6-3-7-13-23/h2-15,20,22H,16-19H2,1H3,(H,28,32)(H,29,31)/p+1/t20-/m1/s1