2-[(1S,2S)-2-(phenylsulfanylmethyl)cyclopropyl]ethanoic acid

Systemtic Name: 2-[(1S,2S)-2-(phenylsulfanylmethyl)cyclopropyl]ethanoic acid Openeye Name: 2-[(1S,2S)-2-(phenylsulfanylmethyl)cyclopropyl]acetic acid CAS Name: 2-[(1S,2S)-2-[(phenylthio)methyl]cyclopropyl]acetic acid IUPAC Name: 2-[(1S,2S)-2-(phenylsulfanylmethyl)cyclopropyl]acetic acid Traditional Name: 2-[(1S,2S)-2-[(phenylthio)methyl]cyclopropyl]acetic acid Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1CSC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1[C@H]([C@H]1CSC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C12H14O2S/c13-12(14)7-9-6-10(9)8-15-11-4-2-1-3-5-11/h1-5,9-10H,6-8H2,(H,13,14)/t9-,10+/m0/s1