3-[2-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid

Systemtic Name: 3-[2-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid Openeye Name: 3-[2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid CAS Name: 3-[2-[[(3-nitrophenyl)-oxomethyl]amino]phenoxy]phthalic acid IUPAC Name: 3-[2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid Traditional Name: 3-[2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid Formula: C21H14N2O8 MolecularWeight: 422.34446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC3=CC=CC(=C3C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC3=CC=CC(=C3C(=O)O)C(=O)O

InChI

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