dimethyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium

Systemtic Name: dimethyl-[[(3S)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium Openeye Name: [(3S)-3-hydroxy-1-[(4-isopropylphenyl)methyl]-2-oxo-3-piperidyl]methyl-dimethyl-ammonium CAS Name: [(3S)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]-3-piperidinyl]methyl-dimethylammonium IUPAC Name: [(3S)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl-dimethylazanium Traditional Name: [(3S)-3-hydroxy-1-(4-isopropylbenzyl)-2-keto-3-piperidyl]methyl-dimethyl-ammonium Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCCC(C2=O)(C[NH+](C)C)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCC[C@@](C2=O)(C[NH+](C)C)O

InChI

InChI=1S/C18H28N2O2/c1-14(2)16-8-6-15(7-9-16)12-20-11-5-10-18(22,17(20)21)13-19(3)4/h6-9,14,22H,5,10-13H2,1-4H3/p+1/t18-/m0/s1