methyl 3-nitro-5-[[(3,4,5-triethoxyphenyl)carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[[(3,4,5-triethoxyphenyl)carbonylamino]carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[[(3,4,5-triethoxybenzoyl)amino]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[[oxo-(3,4,5-triethoxyphenyl)methyl]hydrazo]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[[(3,4,5-triethoxybenzoyl)amino]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[(3,4,5-triethoxybenzoyl)amino]carbamoyl]benzoic acid methyl ester Formula: C22H25N3O9 MolecularWeight: 475.4486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H25N3O9/c1-5-32-17-11-14(12-18(33-6-2)19(17)34-7-3)21(27)24-23-20(26)13-8-15(22(28)31-4)10-16(9-13)25(29)30/h8-12H,5-7H2,1-4H3,(H,23,26)(H,24,27)