2,2-dimethyl-3-phenylsulfanyl-cyclopropane-1-carboxylate

Systemtic Name: 2,2-dimethyl-3-phenylsulfanyl-cyclopropane-1-carboxylate Openeye Name: 2,2-dimethyl-3-phenylsulfanyl-cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(phenylthio)-1-cyclopropanecarboxylate IUPAC Name: 2,2-dimethyl-3-phenylsulfanylcyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-(phenylthio)cyclopropanecarboxylate Formula: C12H13O2S- MolecularWeight: 221.29542

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1SC2=CC=CC=C2)C(=O)[O-])C

Isomeric SMILES

CC1(C(C1SC2=CC=CC=C2)C(=O)[O-])C

InChI

InChI=1S/C12H14O2S/c1-12(2)9(11(13)14)10(12)15-8-6-4-3-5-7-8/h3-7,9-10H,1-2H3,(H,13,14)/p-1