2,2-dimethyl-3-phenylsulfanyl-cyclopropane-1,1-dicarboxylic acid

Systemtic Name: 2,2-dimethyl-3-phenylsulfanyl-cyclopropane-1,1-dicarboxylic acid Openeye Name: 2,2-dimethyl-3-phenylsulfanyl-cyclopropane-1,1-dicarboxylic acid CAS Name: 2,2-dimethyl-3-(phenylthio)cyclopropane-1,1-dicarboxylic acid IUPAC Name: 2,2-dimethyl-3-phenylsulfanylcyclopropane-1,1-dicarboxylic acid Traditional Name: 2,2-dimethyl-3-(phenylthio)cyclopropane-1,1-dicarboxylic acid Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C(=O)O)C(=O)O)SC2=CC=CC=C2)C

Isomeric SMILES

CC1(C(C1(C(=O)O)C(=O)O)SC2=CC=CC=C2)C

InChI

InChI=1S/C13H14O4S/c1-12(2)9(13(12,10(14)15)11(16)17)18-8-6-4-3-5-7-8/h3-7,9H,1-2H3,(H,14,15)(H,16,17)