5-[(3-methoxy-4-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(3-methoxy-4-nitro-phenyl)carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(3-methoxy-4-nitro-benzoyl)amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(3-methoxy-4-nitrophenyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(3-methoxy-4-nitrobenzoyl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(3-methoxy-4-nitro-benzoyl)amino]isophthalic acid Formula: C16H12N2O8 MolecularWeight: 360.27508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O8/c1-26-13-7-8(2-3-12(13)18(24)25)14(19)17-11-5-9(15(20)21)4-10(6-11)16(22)23/h2-7H,1H3,(H,17,19)(H,20,21)(H,22,23)