S-[(3S,4S)-4-methyl-5-oxidanylidene-oxolan-3-yl] benzenecarbothioate

Systemtic Name: S-[(3S,4S)-4-methyl-5-oxidanylidene-oxolan-3-yl] benzenecarbothioate Openeye Name: S-[(3S,4S)-4-methyl-5-oxo-tetrahydrofuran-3-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[(3S,4S)-4-methyl-5-oxo-3-oxolanyl] ester IUPAC Name: S-[(3S,4S)-4-methyl-5-oxooxolan-3-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[(3S,4S)-5-keto-4-methyl-tetrahydrofuran-3-yl] ester Formula: C12H12O3S MolecularWeight: 236.28688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(COC1=O)SC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@@H](COC1=O)SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12O3S/c1-8-10(7-15-11(8)13)16-12(14)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t8-,10-/m1/s1