(3R)-1-[(2S)-1-oxidanylidene-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(2S)-1-oxidanylidene-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(1S)-1-methyl-2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(1S)-2-keto-1-methyl-2-[[(1S)-1-phenylethyl]amino]ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)[NH+]2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)[C@H](C)[NH+]2CCC[C@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c1-17(19-10-5-3-6-11-19)24-22(27)18(2)26-15-9-12-20(16-26)23(28)25-21-13-7-4-8-14-21/h3-8,10-11,13-14,17-18,20H,9,12,15-16H2,1-2H3,(H,24,27)(H,25,28)/p+1/t17-,18-,20+/m0/s1