(4-chlorophenyl) 2-oxidanylidene-5-(phenylsulfanylmethyl)-1,3-oxazolidine-3-sulfonate

Systemtic Name: (4-chlorophenyl) 2-oxidanylidene-5-(phenylsulfanylmethyl)-1,3-oxazolidine-3-sulfonate Openeye Name: (4-chlorophenyl) 2-oxo-5-(phenylsulfanylmethyl)oxazolidine-3-sulfonate CAS Name: 2-oxo-5-[(phenylthio)methyl]-3-oxazolidinesulfonic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 2-oxo-5-(phenylsulfanylmethyl)-1,3-oxazolidine-3-sulfonate Traditional Name: 2-keto-5-[(phenylthio)methyl]oxazolidine-3-sulfonic acid (4-chlorophenyl) ester Formula: C16H14ClNO5S2 MolecularWeight: 399.86906

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1S(=O)(=O)OC2=CC=C(C=C2)Cl)CSC3=CC=CC=C3

Isomeric SMILES

C1C(OC(=O)N1S(=O)(=O)OC2=CC=C(C=C2)Cl)CSC3=CC=CC=C3

InChI

InChI=1S/C16H14ClNO5S2/c17-12-6-8-13(9-7-12)23-25(20,21)18-10-14(22-16(18)19)11-24-15-4-2-1-3-5-15/h1-9,14H,10-11H2