methyl (4S,5R)-5-(3-chloranyl-4-prop-2-enoxy-phenyl)-2-sulfanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: methyl (4S,5R)-5-(3-chloranyl-4-prop-2-enoxy-phenyl)-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: methyl (4S,5R)-5-(4-allyloxy-3-chloro-phenyl)-2-thioxo-oxazolidine-4-carboxylate CAS Name: (4S,5R)-5-(3-chloro-4-prop-2-enoxyphenyl)-2-sulfanylidene-4-oxazolidinecarboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-5-(3-chloro-4-prop-2-enoxyphenyl)-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Traditional Name: (4S,5R)-5-(4-allyloxy-3-chloro-phenyl)-2-thioxo-oxazolidine-4-carboxylic acid methyl ester Formula: C14H14ClNO4S MolecularWeight: 327.78326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(OC(=S)N1)C2=CC(=C(C=C2)OCC=C)Cl

Isomeric SMILES

COC(=O)[C@@H]1[C@H](OC(=S)N1)C2=CC(=C(C=C2)OCC=C)Cl

InChI

InChI=1S/C14H14ClNO4S/c1-3-6-19-10-5-4-8(7-9(10)15)12-11(13(17)18-2)16-14(21)20-12/h3-5,7,11-12H,1,6H2,2H3,(H,16,21)/t11-,12+/m0/s1