diethyl (4E)-3-methylidene-4-[(4-methylphenyl)sulfinylmethylidene]cyclohexane-1,1-dicarboxylate

Systemtic Name: diethyl (4E)-3-methylidene-4-[(4-methylphenyl)sulfinylmethylidene]cyclohexane-1,1-dicarboxylate Openeye Name: diethyl (4E)-3-methylene-4-(p-tolylsulfinylmethylene)cyclohexane-1,1-dicarboxylate CAS Name: (4E)-3-methylene-4-[(4-methylphenyl)sulfinylmethylidene]cyclohexane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4E)-3-methylidene-4-[(4-methylphenyl)sulfinylmethylidene]cyclohexane-1,1-dicarboxylate Traditional Name: (4E)-3-methylene-4-(p-tolylsulfinylmethylene)cyclohexane-1,1-dicarboxylic acid diethyl ester Formula: C21H26O5S MolecularWeight: 390.49314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(=CS(=O)C2=CC=C(C=C2)C)C(=C)C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC/C(=C\S(=O)C2=CC=C(C=C2)C)/C(=C)C1)C(=O)OCC

InChI

InChI=1S/C21H26O5S/c1-5-25-19(22)21(20(23)26-6-2)12-11-17(16(4)13-21)14-27(24)18-9-7-15(3)8-10-18/h7-10,14H,4-6,11-13H2,1-3H3/b17-14+