diethyl 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-oxo-ethoxy)phenyl]-2-oxo-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-oxoethoxy)phenyl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-oxoethoxy)phenyl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-cyano-4-[3-ethoxy-4-(2-ethoxy-2-keto-ethoxy)phenyl]-2-keto-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C28H31NO9S MolecularWeight: 557.61204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)CC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)CC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC)OCC(=O)OCC

InChI

InChI=1S/C28H31NO9S/c1-6-34-22-13-18(10-11-21(22)38-16-24(31)35-7-2)12-19(15-29)20(30)14-23-25(27(32)36-8-3)17(5)26(39-23)28(33)37-9-4/h10-13H,6-9,14,16H2,1-5H3