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

Systemtic Name: (2R)-N-methyl-1-[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-2-carboxamide Openeye Name: (2R)-N-methyl-1-[(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-N-methyl-1-[(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-N-methyl-1-[(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl]piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-[(1S)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]-N-methyl-piperidin-1-ium-2-carboxamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCCCC3C(=O)NC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCCC[C@@H]3C(=O)NC

InChI

InChI=1S/C22H27N3O2/c1-16(25-15-9-8-14-20(25)22(27)23-2)21(26)24-19-13-7-6-12-18(19)17-10-4-3-5-11-17/h3-7,10-13,16,20H,8-9,14-15H2,1-2H3,(H,23,27)(H,24,26)/p+1/t16-,20+/m0/s1