2-cyclohexylsulfanyl-4-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: 2-cyclohexylsulfanyl-4-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 2-cyclohexylsulfanyl-4-oxo-4-phenyl-butanoic acid CAS Name: 2-(cyclohexylthio)-4-oxo-4-phenylbutanoic acid IUPAC Name: 2-cyclohexylsulfanyl-4-oxo-4-phenylbutanoic acid Traditional Name: 2-(cyclohexylthio)-4-keto-4-phenyl-butyric acid Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC(CC(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)SC(CC(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H20O3S/c17-14(12-7-3-1-4-8-12)11-15(16(18)19)20-13-9-5-2-6-10-13/h1,3-4,7-8,13,15H,2,5-6,9-11H2,(H,18,19)