ethyl 3-[2-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-cyclopropyl]-5-methylsulfanyl-furan-2-carboxylate

Systemtic Name: ethyl 3-[2-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-cyclopropyl]-5-methylsulfanyl-furan-2-carboxylate Openeye Name: ethyl 3-[2-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-cyclopropyl]-5-methylsulfanyl-furan-2-carboxylate CAS Name: 3-[2-(3,4-dimethoxyphenyl)-3-ethoxycarbonylcyclopropyl]-5-(methylthio)-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(3,4-dimethoxyphenyl)-3-ethoxycarbonylcyclopropyl]-5-methylsulfanylfuran-2-carboxylate Traditional Name: 3-[2-carbethoxy-3-(3,4-dimethoxyphenyl)cyclopropyl]-5-(methylthio)furan-2-carboxylic acid ethyl ester Formula: C22H26O7S MolecularWeight: 434.50264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C1C2=C(OC(=C2)SC)C(=O)OCC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1C(C1C2=C(OC(=C2)SC)C(=O)OCC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H26O7S/c1-6-27-21(23)19-17(12-8-9-14(25-3)15(10-12)26-4)18(19)13-11-16(30-5)29-20(13)22(24)28-7-2/h8-11,17-19H,6-7H2,1-5H3