ethyl 2-[4-[(2-ethyl-1-benzofuran-3-yl)carbonyl]-2-nitro-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(2-ethyl-1-benzofuran-3-yl)carbonyl]-2-nitro-phenoxy]ethanoate Openeye Name: ethyl 2-[4-(2-ethylbenzofuran-3-carbonyl)-2-nitro-phenoxy]acetate CAS Name: 2-[4-[(2-ethyl-3-benzofuranyl)-oxomethyl]-2-nitrophenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(2-ethyl-1-benzofuran-3-carbonyl)-2-nitrophenoxy]acetate Traditional Name: 2-[4-(2-ethylbenzofuran-3-carbonyl)-2-nitro-phenoxy]acetic acid ethyl ester Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)OCC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C=C3)OCC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C21H19NO7/c1-3-16-20(14-7-5-6-8-17(14)29-16)21(24)13-9-10-18(15(11-13)22(25)26)28-12-19(23)27-4-2/h5-11H,3-4,12H2,1-2H3