1-[(1S)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-2-(diethylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(diethylamino)-2-oxo-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(diethylamino)-2-keto-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)[C@H](C1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2/c1-3-26(4-2)24(29)22(19-11-7-5-8-12-19)27-17-15-20(16-18-27)23(28)25-21-13-9-6-10-14-21/h5-14,20,22H,3-4,15-18H2,1-2H3,(H,25,28)/p+1/t22-/m0/s1