(3aR,7aS)-2,2-dimethyl-4-(2-phenylsulfanylethyl)-3a,7a-dihydro-1,3-benzodioxole

Systemtic Name: (3aR,7aS)-2,2-dimethyl-4-(2-phenylsulfanylethyl)-3a,7a-dihydro-1,3-benzodioxole Openeye Name: (3aR,7aS)-2,2-dimethyl-4-(2-phenylsulfanylethyl)-3a,7a-dihydro-1,3-benzodioxole CAS Name: (3aR,7aS)-2,2-dimethyl-4-[2-(phenylthio)ethyl]-3a,7a-dihydro-1,3-benzodioxole IUPAC Name: (3aR,7aS)-2,2-dimethyl-4-(2-phenylsulfanylethyl)-3a,7a-dihydro-1,3-benzodioxole Traditional Name: (3aR,7aS)-2,2-dimethyl-4-[2-(phenylthio)ethyl]-3a,7a-dihydro-1,3-benzodioxole Formula: C17H20O2S MolecularWeight: 288.4045

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C=CC=C(C2O1)CCSC3=CC=CC=C3)C

Isomeric SMILES

CC1(O[C@H]2C=CC=C([C@H]2O1)CCSC3=CC=CC=C3)C

InChI

InChI=1S/C17H20O2S/c1-17(2)18-15-10-6-7-13(16(15)19-17)11-12-20-14-8-4-3-5-9-14/h3-10,15-16H,11-12H2,1-2H3/t15-,16+/m0/s1