methyl-[[(3R)-1-[(3-methylphenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]-(oxan-4-yl)azanium

Systemtic Name: methyl-[[(3R)-1-[(3-methylphenyl)methyl]-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl]-(oxan-4-yl)azanium Openeye Name: [(3R)-3-hydroxy-1-(m-tolylmethyl)-2-oxo-3-piperidyl]methyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [(3R)-3-hydroxy-1-[(3-methylphenyl)methyl]-2-oxo-3-piperidinyl]methyl-methyl-(4-oxanyl)ammonium IUPAC Name: [(3R)-3-hydroxy-1-[(3-methylphenyl)methyl]-2-oxopiperidin-3-yl]methyl-methyl-(oxan-4-yl)azanium Traditional Name: [(3R)-3-hydroxy-2-keto-1-(3-methylbenzyl)-3-piperidyl]methyl-methyl-tetrahydropyran-4-yl-ammonium Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCCC(C2=O)(C[NH+](C)C3CCOCC3)O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC[C@](C2=O)(C[NH+](C)C3CCOCC3)O

InChI

InChI=1S/C20H30N2O3/c1-16-5-3-6-17(13-16)14-22-10-4-9-20(24,19(22)23)15-21(2)18-7-11-25-12-8-18/h3,5-6,13,18,24H,4,7-12,14-15H2,1-2H3/p+1/t20-/m1/s1