(3S)-1-(2-oxidanylidene-2-phenylazanyl-ethyl)-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(2-oxidanylidene-2-phenylazanyl-ethyl)-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-(2-anilino-2-oxo-ethyl)-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-(2-anilino-2-oxoethyl)-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-(2-anilino-2-oxoethyl)-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-(2-anilino-2-keto-ethyl)-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC(=O)NC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2/c24-19(21-17-9-3-1-4-10-17)15-23-13-7-8-16(14-23)20(25)22-18-11-5-2-6-12-18/h1-6,9-12,16H,7-8,13-15H2,(H,21,24)(H,22,25)/p+1/t16-/m0/s1