diethyl 5-[3-cyano-4-[2-(cyanomethoxy)naphthalen-1-yl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[3-cyano-4-[2-(cyanomethoxy)naphthalen-1-yl]-2-oxidanylidene-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[3-cyano-4-[2-(cyanomethoxy)-1-naphthyl]-2-oxo-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[3-cyano-4-[2-(cyanomethoxy)-1-naphthalenyl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-cyano-4-[2-(cyanomethoxy)naphthalen-1-yl]-2-oxobut-3-enyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-cyano-4-[2-(cyanomethoxy)-1-naphthyl]-2-keto-but-3-enyl]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C28H24N2O6S MolecularWeight: 516.56496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC#N)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)CC(=O)C(=CC2=C(C=CC3=CC=CC=C32)OCC#N)C#N

InChI

InChI=1S/C28H24N2O6S/c1-4-34-27(32)25-17(3)26(28(33)35-5-2)37-24(25)15-22(31)19(16-30)14-21-20-9-7-6-8-18(20)10-11-23(21)36-13-12-29/h6-11,14H,4-5,13,15H2,1-3H3