[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(benzofuran-2-yl)-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [2-(2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(1-benzofuran-2-yl)-2-oxoethyl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-(benzofuran-2-yl)-2-keto-ethyl] ester Formula: C20H17NO8 MolecularWeight: 399.35088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3O2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3O2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H17NO8/c1-3-27-19-9-13(14(21(24)25)10-18(19)26-2)20(23)28-11-15(22)17-8-12-6-4-5-7-16(12)29-17/h4-10H,3,11H2,1-2H3