dimethyl 2-[(2-methylsulfanylphenyl)methyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(2-methylsulfanylphenyl)methyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(2-methylsulfanylphenyl)methyl]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(methylthio)phenyl]methyl]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-methylsulfanylphenyl)methyl]benzene-1,4-dicarboxylate Traditional Name: 2-[2-(methylthio)benzyl]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)CC2=CC=CC=C2SC

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)CC2=CC=CC=C2SC

InChI

InChI=1S/C18H18O4S/c1-21-17(19)13-8-9-15(18(20)22-2)14(11-13)10-12-6-4-5-7-16(12)23-3/h4-9,11H,10H2,1-3H3