ethyl 4-chloranyl-5-[(E)-hydroxyiminomethyl]-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 4-chloranyl-5-[(E)-hydroxyiminomethyl]-3-methyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 4-chloro-5-[(E)-hydroxyiminomethyl]-3-methyl-benzofuran-2-carboxylate CAS Name: 4-chloro-5-[(E)-hydroxyiminomethyl]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-[(E)-hydroxyiminomethyl]-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-chloro-5-[(E)-hydroximinomethyl]-3-methyl-coumarilic acid ethyl ester Formula: C13H12ClNO4 MolecularWeight: 281.69168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)C=NO)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2Cl)/C=N/O)C

InChI

InChI=1S/C13H12ClNO4/c1-3-18-13(16)12-7(2)10-9(19-12)5-4-8(6-15-17)11(10)14/h4-6,17H,3H2,1-2H3/b15-6+