ethyl 5-azanyl-4-cyano-3-[(4-methoxy-2-oxidanyl-phenyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-methoxy-2-oxidanyl-phenyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(2-hydroxy-4-methoxy-benzoyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(2-hydroxy-4-methoxyphenyl)-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2-hydroxy-4-methoxybenzoyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2-hydroxy-4-methoxy-benzoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C17H16N2O6S MolecularWeight: 376.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=C(C=C2)OC)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=C(C=C2)OC)O

InChI

InChI=1S/C17H16N2O6S/c1-3-24-17(22)14-12(11(7-18)15(19)26-14)8-25-16(21)10-5-4-9(23-2)6-13(10)20/h4-6,20H,3,8,19H2,1-2H3