dimethyl-[[(3S,4R)-4-oxidanyl-4-phenyl-thian-3-yl]methyl]azanium

Systemtic Name: dimethyl-[[(3S,4R)-4-oxidanyl-4-phenyl-thian-3-yl]methyl]azanium Openeye Name: [(3S,4R)-4-hydroxy-4-phenyl-tetrahydrothiopyran-3-yl]methyl-dimethyl-ammonium CAS Name: [(3S,4R)-4-hydroxy-4-phenyl-3-thianyl]methyl-dimethylammonium IUPAC Name: [(3S,4R)-4-hydroxy-4-phenylthian-3-yl]methyl-dimethylazanium Traditional Name: [(3S,4R)-4-hydroxy-4-phenyl-tetrahydrothiopyran-3-yl]methyl-dimethyl-ammonium Formula: C14H22NOS+ MolecularWeight: 252.39558

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1CSCCC1(C2=CC=CC=C2)O

Isomeric SMILES

C[NH+](C)C[C@@H]1CSCC[C@@]1(C2=CC=CC=C2)O

InChI

InChI=1S/C14H21NOS/c1-15(2)10-13-11-17-9-8-14(13,16)12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3/p+1/t13-,14+/m1/s1