methyl 5-(3-cyano-4-ethoxy-4-oxidanylidene-butyl)thiophene-2-carboxylate

Systemtic Name: methyl 5-(3-cyano-4-ethoxy-4-oxidanylidene-butyl)thiophene-2-carboxylate Openeye Name: methyl 5-(3-cyano-4-ethoxy-4-oxo-butyl)thiophene-2-carboxylate CAS Name: 5-(3-cyano-4-ethoxy-4-oxobutyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(3-cyano-4-ethoxy-4-oxobutyl)thiophene-2-carboxylate Traditional Name: 5-(3-cyano-4-ethoxy-4-keto-butyl)thiophene-2-carboxylic acid methyl ester Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=C(S1)C(=O)OC)C#N

Isomeric SMILES

CCOC(=O)C(CCC1=CC=C(S1)C(=O)OC)C#N

InChI

InChI=1S/C13H15NO4S/c1-3-18-12(15)9(8-14)4-5-10-6-7-11(19-10)13(16)17-2/h6-7,9H,3-5H2,1-2H3