(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid (2-ethoxycarbonyl-3-benzofuranyl)methyl ester IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (2-carbethoxybenzofuran-3-yl)methyl ester Formula: C18H16N2O7 MolecularWeight: 372.32884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC(=CN3C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC(=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O7/c1-3-25-18(22)16-13(12-6-4-5-7-15(12)27-16)10-26-17(21)14-8-11(20(23)24)9-19(14)2/h4-9H,3,10H2,1-2H3