N-methyl-2-oxidanylidene-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-4-phenyl-butanamide

Systemtic Name: N-methyl-2-oxidanylidene-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-4-phenyl-butanamide Openeye Name: N-methyl-2-oxo-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-4-phenyl-butanamide CAS Name: N-methyl-2-oxo-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-4-phenylbutanamide IUPAC Name: N-methyl-2-oxo-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-4-phenylbutanamide Traditional Name: 2-keto-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-4-phenyl-butyramide Formula: C24H31N2O2+ MolecularWeight: 379.51514

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O2/c1-25(24(28)23(27)15-14-20-9-4-2-5-10-20)22-13-8-17-26(19-22)18-16-21-11-6-3-7-12-21/h2-7,9-12,22H,8,13-19H2,1H3/p+1/t22-/m0/s1