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

Systemtic Name: 2-methoxy-5-[[(2-methoxy-5-nitro-phenyl)carbonylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[(2-methoxy-5-nitro-benzoyl)amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[(2-methoxy-5-nitrophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[(2-methoxy-5-nitrobenzoyl)amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[(2-methoxy-5-nitro-benzoyl)amino]methyl]benzoic acid Formula: C17H16N2O7 MolecularWeight: 360.31814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O7/c1-25-14-6-4-11(19(23)24)8-12(14)16(20)18-9-10-3-5-15(26-2)13(7-10)17(21)22/h3-8H,9H2,1-2H3,(H,18,20)(H,21,22)