[(2S,3S)-1,1-dimethyl-7-oxidanyl-3-phenylsulfanyl-3,4-dihydro-2H-naphthalen-2-yl]azanium chloride

Systemtic Name: [(2S,3S)-1,1-dimethyl-7-oxidanyl-3-phenylsulfanyl-3,4-dihydro-2H-naphthalen-2-yl]azanium chloride Openeye Name: [(2S,3S)-7-hydroxy-1,1-dimethyl-3-phenylsulfanyl-tetralin-2-yl]ammonium chloride CAS Name: [(2S,3S)-7-hydroxy-1,1-dimethyl-3-(phenylthio)-3,4-dihydro-2H-naphthalen-2-yl]ammonium chloride IUPAC Name: [(2S,3S)-7-hydroxy-1,1-dimethyl-3-phenylsulfanyl-3,4-dihydro-2H-naphthalen-2-yl]azanium chloride Traditional Name: [(2S,3S)-7-hydroxy-1,1-dimethyl-3-(phenylthio)tetralin-2-yl]ammonium chloride Formula: C18H22ClNOS MolecularWeight: 335.89138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(CC2=C1C=C(C=C2)O)SC3=CC=CC=C3)[NH3+])C.[Cl-]

Isomeric SMILES

CC1([C@@H]([C@H](CC2=C1C=C(C=C2)O)SC3=CC=CC=C3)[NH3+])C.[Cl-]

InChI

InChI=1S/C18H21NOS.ClH/c1-18(2)15-11-13(20)9-8-12(15)10-16(17(18)19)21-14-6-4-3-5-7-14;/h3-9,11,16-17,20H,10,19H2,1-2H3;1H/t16-,17+;/m0./s1