5-[2-(3-nitrophenoxy)ethanoylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[2-(3-nitrophenoxy)ethanoylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[2-(3-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[2-(3-nitrophenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[2-(3-nitrophenoxy)acetyl]amino]isophthalic acid Formula: C16H12N2O8 MolecularWeight: 360.27508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O8/c19-14(8-26-13-3-1-2-12(7-13)18(24)25)17-11-5-9(15(20)21)4-10(6-11)16(22)23/h1-7H,8H2,(H,17,19)(H,20,21)(H,22,23)