methyl (3aS,4R,7aS)-4-methylsulfanyl-1-oxidanylidene-7,7a-dihydro-4H-indene-3a-carboxylate

Systemtic Name: methyl (3aS,4R,7aS)-4-methylsulfanyl-1-oxidanylidene-7,7a-dihydro-4H-indene-3a-carboxylate Openeye Name: methyl (3aS,4R,7aS)-4-methylsulfanyl-1-oxo-7,7a-dihydro-4H-indene-3a-carboxylate CAS Name: (3aS,4R,7aS)-4-(methylthio)-1-oxo-7,7a-dihydro-4H-indene-3a-carboxylic acid methyl ester IUPAC Name: methyl (3aS,4R,7aS)-4-methylsulfanyl-1-oxo-7,7a-dihydro-4H-indene-3a-carboxylate Traditional Name: (3aS,4R,7aS)-1-keto-4-(methylthio)-7,7a-dihydro-4H-indene-3a-carboxylic acid methyl ester Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12C=CC(=O)C1CC=CC2SC

Isomeric SMILES

COC(=O)[C@]12C=CC(=O)[C@H]1CC=C[C@H]2SC

InChI

InChI=1S/C12H14O3S/c1-15-11(14)12-7-6-9(13)8(12)4-3-5-10(12)16-2/h3,5-8,10H,4H2,1-2H3/t8-,10-,12-/m1/s1