S-[(2-oxidanylideneoxolan-3-yl)methyl] 4-methylbenzenecarbothioate

Systemtic Name: S-[(2-oxidanylideneoxolan-3-yl)methyl] 4-methylbenzenecarbothioate Openeye Name: S-[(2-oxotetrahydrofuran-3-yl)methyl] 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[(2-oxo-3-oxolanyl)methyl] ester IUPAC Name: S-[(2-oxooxolan-3-yl)methyl] 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-[(2-ketotetrahydrofuran-3-yl)methyl] ester Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SCC2CCOC2=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SCC2CCOC2=O

InChI

InChI=1S/C13H14O3S/c1-9-2-4-10(5-3-9)13(15)17-8-11-6-7-16-12(11)14/h2-5,11H,6-8H2,1H3