2-(3-chloranyl-4-cyclohexyl-2-sulfanyl-phenyl)ethanoic acid; methane

Systemtic Name: 2-(3-chloranyl-4-cyclohexyl-2-sulfanyl-phenyl)ethanoic acid; methane Openeye Name: 2-(3-chloro-4-cyclohexyl-2-sulfanyl-phenyl)acetic acid; methane CAS Name: 2-(3-chloro-4-cyclohexyl-2-mercaptophenyl)acetic acid; methane IUPAC Name: 2-(3-chloro-4-cyclohexyl-2-sulfanylphenyl)acetic acid; methane Traditional Name: 2-(3-chloro-4-cyclohexyl-2-mercapto-phenyl)acetic acid; methane Formula: C15H21ClO2S MolecularWeight: 300.84404

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Descriptors Computed from Structure

Canonical SMILES:

C.C1CCC(CC1)C2=C(C(=C(C=C2)CC(=O)O)S)Cl

Isomeric SMILES

C.C1CCC(CC1)C2=C(C(=C(C=C2)CC(=O)O)S)Cl

InChI

InChI=1S/C14H17ClO2S.CH4/c15-13-11(9-4-2-1-3-5-9)7-6-10(14(13)18)8-12(16)17;/h6-7,9,18H,1-5,8H2,(H,16,17);1H4