5-[[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[(4,5-dimethoxy-2-nitro-benzoyl)amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[(4,5-dimethoxy-2-nitrobenzoyl)amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[(4,5-dimethoxy-2-nitro-benzoyl)amino]methyl]-2-methoxy-benzoic acid Formula: C18H18N2O8 MolecularWeight: 390.34412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C(=O)O

InChI

InChI=1S/C18H18N2O8/c1-26-14-5-4-10(6-12(14)18(22)23)9-19-17(21)11-7-15(27-2)16(28-3)8-13(11)20(24)25/h4-8H,9H2,1-3H3,(H,19,21)(H,22,23)