ethyl 3-methyl-6-nitro-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-6-nitro-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-methyl-6-nitro-benzofuran-2-carboxylate CAS Name: 3-methyl-6-nitro-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-6-nitro-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-6-nitro-coumarilic acid ethyl ester Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H11NO5/c1-3-17-12(14)11-7(2)9-5-4-8(13(15)16)6-10(9)18-11/h4-6H,3H2,1-2H3