(1-phenylsulfanylcyclopropyl) 2,2-dimethylpropanoate

Systemtic Name: (1-phenylsulfanylcyclopropyl) 2,2-dimethylpropanoate Openeye Name: (1-phenylsulfanylcyclopropyl) 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [1-(phenylthio)cyclopropyl] ester IUPAC Name: (1-phenylsulfanylcyclopropyl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-(phenylthio)cyclopropyl] ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1(CC1)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OC1(CC1)SC2=CC=CC=C2

InChI

InChI=1S/C14H18O2S/c1-13(2,3)12(15)16-14(9-10-14)17-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3