ethyl 5-azanyl-4-cyano-3-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-methyl-2-oxo-chromen-7-yl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxymethyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-methyl-2-oxochromen-7-yl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2-keto-4-methyl-chromen-7-yl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C19H16N2O5S/c1-3-24-19(23)17-14(13(8-20)18(21)27-17)9-25-11-4-5-12-10(2)6-16(22)26-15(12)7-11/h4-7H,3,9,21H2,1-2H3