ethyl 4-cyano-5-[3-cyano-4-(3-methoxy-4-phenylmethoxy-phenyl)-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-cyano-4-(3-methoxy-4-phenylmethoxy-phenyl)-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[4-(4-benzyloxy-3-methoxy-phenyl)-3-cyano-2-oxo-but-3-enyl]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[3-cyano-4-(3-methoxy-4-phenylmethoxyphenyl)-2-oxobut-3-enyl]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-cyano-4-(3-methoxy-4-phenylmethoxyphenyl)-2-oxobut-3-enyl]-3-methylthiophene-2-carboxylate Traditional Name: 5-[4-(4-benzoxy-3-methoxy-phenyl)-3-cyano-2-keto-but-3-enyl]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C28H24N2O5S MolecularWeight: 500.56556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)CC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C#N)C#N)C

InChI

InChI=1S/C28H24N2O5S/c1-4-34-28(32)27-18(2)22(16-30)26(36-27)14-23(31)21(15-29)12-20-10-11-24(25(13-20)33-3)35-17-19-8-6-5-7-9-19/h5-13H,4,14,17H2,1-3H3