2-[(4-cyclohexylphenyl)methylsulfanyl]-3-ethoxy-2-methyl-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[(4-cyclohexylphenyl)methylsulfanyl]-3-ethoxy-2-methyl-3-oxidanylidene-propanoic acid Openeye Name: 2-[(4-cyclohexylphenyl)methylsulfanyl]-3-ethoxy-2-methyl-3-oxo-propanoic acid CAS Name: 2-[(4-cyclohexylphenyl)methylthio]-3-ethoxy-2-methyl-3-oxopropanoic acid IUPAC Name: 2-[(4-cyclohexylphenyl)methylsulfanyl]-3-ethoxy-2-methyl-3-oxopropanoic acid Traditional Name: 2-[(4-cyclohexylbenzyl)thio]-3-ethoxy-3-keto-2-methyl-propionic acid Formula: C19H26O4S MolecularWeight: 350.47234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(=O)O)SCC1=CC=C(C=C1)C2CCCCC2

Isomeric SMILES

CCOC(=O)C(C)(C(=O)O)SCC1=CC=C(C=C1)C2CCCCC2

InChI

InChI=1S/C19H26O4S/c1-3-23-18(22)19(2,17(20)21)24-13-14-9-11-16(12-10-14)15-7-5-4-6-8-15/h9-12,15H,3-8,13H2,1-2H3,(H,20,21)