methyl 2-methyl-3-[(5-nitro-1-benzofuran-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-methyl-3-[(5-nitro-1-benzofuran-3-yl)carbonylamino]benzoate Openeye Name: methyl 2-methyl-3-[(5-nitrobenzofuran-3-carbonyl)amino]benzoate CAS Name: 2-methyl-3-[[(5-nitro-3-benzofuranyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[(5-nitro-1-benzofuran-3-carbonyl)amino]benzoate Traditional Name: 2-methyl-3-[(5-nitrobenzofuran-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=COC3=C2C=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H14N2O6/c1-10-12(18(22)25-2)4-3-5-15(10)19-17(21)14-9-26-16-7-6-11(20(23)24)8-13(14)16/h3-9H,1-2H3,(H,19,21)