dimethyl 4-(4-chlorophenyl)sulfanyl-3-oxidanyl-benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-(4-chlorophenyl)sulfanyl-3-oxidanyl-benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-(4-chlorophenyl)sulfanyl-3-hydroxy-benzene-1,2-dicarboxylate CAS Name: 4-[(4-chlorophenyl)thio]-3-hydroxybenzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(4-chlorophenyl)sulfanyl-3-hydroxybenzene-1,2-dicarboxylate Traditional Name: 4-[(4-chlorophenyl)thio]-3-hydroxy-benzene-1,2-dicarboxylic acid dimethyl ester Formula: C16H13ClO5S MolecularWeight: 352.78942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)SC2=CC=C(C=C2)Cl)O)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)SC2=CC=C(C=C2)Cl)O)C(=O)OC

InChI

InChI=1S/C16H13ClO5S/c1-21-15(19)11-7-8-12(14(18)13(11)16(20)22-2)23-10-5-3-9(17)4-6-10/h3-8,18H,1-2H3