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4-[4-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid

4-[4-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid

Systemtic Name:4-[4-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid
Openeye Name:4-[4-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid
CAS Name:4-[4-[[(3-nitrophenyl)-oxomethyl]amino]phenoxy]phthalic acid
IUPAC Name:4-[4-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid
Traditional Name:4-[4-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid
Formula: C21H14N2O8
MolecularWeight: 422.34446
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H14N2O8/c24-19(12-2-1-3-14(10-12)23(29)30)22-13-4-6-15(7-5-13)31-16-8-9-17(20(25)26)18(11-16)21(27)28/h1-11H,(H,22,24)(H,25,26)(H,27,28)


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