ethyl 5-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[2-(4-methoxy-2-nitro-anilino)-2-oxo-ethoxy]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[2-(4-methoxy-2-nitroanilino)-2-oxoethoxy]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-methoxy-2-nitroanilino)-2-oxoethoxy]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[2-keto-2-(4-methoxy-2-nitro-anilino)ethoxy]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H20N2O8 MolecularWeight: 428.3921

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C21H20N2O8/c1-4-29-21(25)20-12(2)31-18-8-6-14(9-15(18)20)30-11-19(24)22-16-7-5-13(28-3)10-17(16)23(26)27/h5-10H,4,11H2,1-3H3,(H,22,24)