methyl (2R,5S)-3-azanylidene-5-phenyl-thiolane-2-carboxylate

Systemtic Name: methyl (2R,5S)-3-azanylidene-5-phenyl-thiolane-2-carboxylate Openeye Name: methyl (2R,5S)-3-imino-5-phenyl-tetrahydrothiophene-2-carboxylate CAS Name: (2R,5S)-3-imino-5-phenyl-2-thiolanecarboxylic acid methyl ester IUPAC Name: methyl (2R,5S)-3-imino-5-phenylthiolane-2-carboxylate Traditional Name: (2R,5S)-3-imino-5-phenyl-tetrahydrothiophene-2-carboxylic acid methyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=N)CC(S1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H]1C(=N)C[C@H](S1)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO2S/c1-15-12(14)11-9(13)7-10(16-11)8-5-3-2-4-6-8/h2-6,10-11,13H,7H2,1H3/t10-,11+/m0/s1