diethyl 3-(bromomethyl)-4-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)thiophene-2,5-dicarboxylate

Systemtic Name: diethyl 3-(bromomethyl)-4-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)thiophene-2,5-dicarboxylate Openeye Name: diethyl 3-(bromomethyl)-4-(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)thiophene-2,5-dicarboxylate CAS Name: 3-(bromomethyl)-4-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)thiophene-2,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(bromomethyl)-4-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)thiophene-2,5-dicarboxylate Traditional Name: 3-(bromomethyl)-4-(2-carbethoxy-3-ethoxy-3-keto-prop-1-enyl)thiophene-2,5-dicarboxylic acid diethyl ester Formula: C19H23BrO8S MolecularWeight: 491.35012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)C(=O)OCC)C=C(C(=O)OCC)C(=O)OCC)CBr

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)C(=O)OCC)C=C(C(=O)OCC)C(=O)OCC)CBr

InChI

InChI=1S/C19H23BrO8S/c1-5-25-16(21)12(17(22)26-6-2)9-11-13(10-20)15(19(24)28-8-4)29-14(11)18(23)27-7-3/h9H,5-8,10H2,1-4H3