diethyl 2-[(E)-4-methoxy-4-oxidanylidene-2-phenylsulfanyl-but-2-enyl]-4-oxidanylidene-cyclohexane-1,1-dicarboxylate

Systemtic Name: diethyl 2-[(E)-4-methoxy-4-oxidanylidene-2-phenylsulfanyl-but-2-enyl]-4-oxidanylidene-cyclohexane-1,1-dicarboxylate Openeye Name: diethyl 2-[(E)-4-methoxy-4-oxo-2-phenylsulfanyl-but-2-enyl]-4-oxo-cyclohexane-1,1-dicarboxylate CAS Name: 2-[(E)-4-methoxy-4-oxo-2-(phenylthio)but-2-enyl]-4-oxocyclohexane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-[(E)-4-methoxy-4-oxo-2-phenylsulfanylbut-2-enyl]-4-oxocyclohexane-1,1-dicarboxylate Traditional Name: 4-keto-2-[(E)-4-keto-4-methoxy-2-(phenylthio)but-2-enyl]cyclohexane-1,1-dicarboxylic acid diethyl ester Formula: C23H28O7S MolecularWeight: 448.52922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(=O)CC1CC(=CC(=O)OC)SC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCC(=O)CC1C/C(=C\C(=O)OC)/SC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H28O7S/c1-4-29-21(26)23(22(27)30-5-2)12-11-17(24)13-16(23)14-19(15-20(25)28-3)31-18-9-7-6-8-10-18/h6-10,15-16H,4-5,11-14H2,1-3H3/b19-15+