(3S,4R)-4-chloranyl-2,2-dimethyl-1-phenylsulfanyl-heptan-3-ol

Systemtic Name: (3S,4R)-4-chloranyl-2,2-dimethyl-1-phenylsulfanyl-heptan-3-ol Openeye Name: (3S,4R)-4-chloro-2,2-dimethyl-1-phenylsulfanyl-heptan-3-ol CAS Name: (3S,4R)-4-chloro-2,2-dimethyl-1-(phenylthio)-3-heptanol IUPAC Name: (3S,4R)-4-chloro-2,2-dimethyl-1-phenylsulfanylheptan-3-ol Traditional Name: (3S,4R)-4-chloro-2,2-dimethyl-1-(phenylthio)heptan-3-ol Formula: C15H23ClOS MolecularWeight: 286.86052

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(C)(C)CSC1=CC=CC=C1)O)Cl

Isomeric SMILES

CCC[C@H]([C@H](C(C)(C)CSC1=CC=CC=C1)O)Cl

InChI

InChI=1S/C15H23ClOS/c1-4-8-13(16)14(17)15(2,3)11-18-12-9-6-5-7-10-12/h5-7,9-10,13-14,17H,4,8,11H2,1-3H3/t13-,14-/m1/s1