2,6,6-trimethyl-3-phenylsulfanyl-cyclohept-4-en-1-ol

Systemtic Name: 2,6,6-trimethyl-3-phenylsulfanyl-cyclohept-4-en-1-ol Openeye Name: 2,6,6-trimethyl-3-phenylsulfanyl-cyclohept-4-en-1-ol CAS Name: 2,6,6-trimethyl-3-(phenylthio)-1-cyclohept-4-enol IUPAC Name: 2,6,6-trimethyl-3-phenylsulfanylcyclohept-4-en-1-ol Traditional Name: 2,6,6-trimethyl-3-(phenylthio)cyclohept-4-en-1-ol Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(C=CC1SC2=CC=CC=C2)(C)C)O

Isomeric SMILES

CC1C(CC(C=CC1SC2=CC=CC=C2)(C)C)O

InChI

InChI=1S/C16H22OS/c1-12-14(17)11-16(2,3)10-9-15(12)18-13-7-5-4-6-8-13/h4-10,12,14-15,17H,11H2,1-3H3