ethyl 5-azanyl-3-[(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[(6-chloro-4-methyl-2-oxo-chromen-7-yl)oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[(6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl)oxymethyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(6-chloro-4-methyl-2-oxochromen-7-yl)oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[(6-chloro-2-keto-4-methyl-chromen-7-yl)oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C19H15ClN2O5S MolecularWeight: 418.8508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C(C=C3C(=CC(=O)OC3=C2)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C(C=C3C(=CC(=O)OC3=C2)C)Cl

InChI

InChI=1S/C19H15ClN2O5S/c1-3-25-19(24)17-12(11(7-21)18(22)28-17)8-26-15-6-14-10(5-13(15)20)9(2)4-16(23)27-14/h4-6H,3,8,22H2,1-2H3