6-chloranyl-1,3,3-trimethyl-2-(phenylsulfanylmethyl)cyclohexene

Systemtic Name: 6-chloranyl-1,3,3-trimethyl-2-(phenylsulfanylmethyl)cyclohexene Openeye Name: 6-chloro-1,3,3-trimethyl-2-(phenylsulfanylmethyl)cyclohexene CAS Name: 6-chloro-1,3,3-trimethyl-2-[(phenylthio)methyl]cyclohexene IUPAC Name: 6-chloro-1,3,3-trimethyl-2-(phenylsulfanylmethyl)cyclohexene Traditional Name: 6-chloro-1,3,3-trimethyl-2-[(phenylthio)methyl]cyclohexene Formula: C16H21ClS MolecularWeight: 280.85594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1Cl)(C)C)CSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(CCC1Cl)(C)C)CSC2=CC=CC=C2

InChI

InChI=1S/C16H21ClS/c1-12-14(16(2,3)10-9-15(12)17)11-18-13-7-5-4-6-8-13/h4-8,15H,9-11H2,1-3H3