ethyl 1-(1-benzofuran-2-yl)-5-nitro-1H-isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-(1-benzofuran-2-yl)-5-nitro-1H-isoquinoline-2-carboxylate Openeye Name: ethyl 1-(benzofuran-2-yl)-5-nitro-1H-isoquinoline-2-carboxylate CAS Name: 1-(2-benzofuranyl)-5-nitro-1H-isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-benzofuran-2-yl)-5-nitro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(benzofuran-2-yl)-5-nitro-1H-isoquinoline-2-carboxylic acid ethyl ester Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC2=C(C1C3=CC4=CC=CC=C4O3)C=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1C=CC2=C(C1C3=CC4=CC=CC=C4O3)C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O5/c1-2-26-20(23)21-11-10-14-15(7-5-8-16(14)22(24)25)19(21)18-12-13-6-3-4-9-17(13)27-18/h3-12,19H,2H2,1H3