methyl (4S)-4-benzamido-3-oxidanylidene-thiolane-2-carboxylate

Systemtic Name: methyl (4S)-4-benzamido-3-oxidanylidene-thiolane-2-carboxylate Openeye Name: methyl (4S)-4-benzamido-3-oxo-tetrahydrothiophene-2-carboxylate CAS Name: (4S)-4-benzamido-3-oxo-2-thiolanecarboxylic acid methyl ester IUPAC Name: methyl (4S)-4-benzamido-3-oxothiolane-2-carboxylate Traditional Name: (4S)-4-benzamido-3-keto-tetrahydrothiophene-2-carboxylic acid methyl ester Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)C(CS1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1C(=O)[C@@H](CS1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13NO4S/c1-18-13(17)11-10(15)9(7-19-11)14-12(16)8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3,(H,14,16)/t9-,11?/m1/s1