3,4-bis[(4-nitrophenoxy)carbonylamino]phthalic acid

Systemtic Name: 3,4-bis[(4-nitrophenoxy)carbonylamino]phthalic acid Openeye Name: 3,4-bis[(4-nitrophenoxy)carbonylamino]phthalic acid CAS Name: 3,4-bis[[(4-nitrophenoxy)-oxomethyl]amino]phthalic acid IUPAC Name: 3,4-bis[(4-nitrophenoxy)carbonylamino]phthalic acid Traditional Name: 3,4-bis[(4-nitrophenoxy)carbonylamino]phthalic acid Formula: C22H14N4O12 MolecularWeight: 526.36616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)NC2=C(C(=C(C=C2)C(=O)O)C(=O)O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC(=O)NC2=C(C(=C(C=C2)C(=O)O)C(=O)O)NC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O12/c27-19(28)15-9-10-16(23-21(31)37-13-5-1-11(2-6-13)25(33)34)18(17(15)20(29)30)24-22(32)38-14-7-3-12(4-8-14)26(35)36/h1-10H,(H,23,31)(H,24,32)(H,27,28)(H,29,30)