2-[[(2R,3S)-2-(2-methoxyphenyl)-1-(4-methylphenyl)-6-oxidanylidene-piperidin-3-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2R,3S)-2-(2-methoxyphenyl)-1-(4-methylphenyl)-6-oxidanylidene-piperidin-3-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2R,3S)-2-(2-methoxyphenyl)-6-oxo-1-(p-tolyl)piperidine-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[(2R,3S)-2-(2-methoxyphenyl)-1-(4-methylphenyl)-6-oxo-3-piperidinyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2R,3S)-2-(2-methoxyphenyl)-1-(4-methylphenyl)-6-oxopiperidine-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(2R,3S)-6-keto-2-(2-methoxyphenyl)-1-(p-tolyl)nipecotoyl]amino]ethyl-dimethyl-ammonium Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCC[NH+](C)C)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@H]([C@H](CCC2=O)C(=O)NCC[NH+](C)C)C3=CC=CC=C3OC

InChI

InChI=1S/C24H31N3O3/c1-17-9-11-18(12-10-17)27-22(28)14-13-20(24(29)25-15-16-26(2)3)23(27)19-7-5-6-8-21(19)30-4/h5-12,20,23H,13-16H2,1-4H3,(H,25,29)/p+1/t20-,23-/m0/s1