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

Systemtic Name: ethyl 3-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(3-methyl-2-benzofuranyl)-oxomethyl]hydrazo]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[(3-methyl-1-benzofuran-2-carbonyl)amino]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)C2=C(C3=CC=CC=C3O2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NNC(=O)C2=C(C3=CC=CC=C3O2)C)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O7/c1-3-29-20(26)13-8-12(9-14(10-13)23(27)28)18(24)21-22-19(25)17-11(2)15-6-4-5-7-16(15)30-17/h4-10H,3H2,1-2H3,(H,21,24)(H,22,25)