4-[3-[2-(2-nitrophenoxy)ethanoylamino]phenoxy]phthalic acid

Systemtic Name: 4-[3-[2-(2-nitrophenoxy)ethanoylamino]phenoxy]phthalic acid Openeye Name: 4-[3-[[2-(2-nitrophenoxy)acetyl]amino]phenoxy]phthalic acid CAS Name: 4-[3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[3-[[2-(2-nitrophenoxy)acetyl]amino]phenoxy]phthalic acid Traditional Name: 4-[3-[[2-(2-nitrophenoxy)acetyl]amino]phenoxy]phthalic acid Formula: C22H16N2O9 MolecularWeight: 452.37044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16N2O9/c25-20(12-32-19-7-2-1-6-18(19)24(30)31)23-13-4-3-5-14(10-13)33-15-8-9-16(21(26)27)17(11-15)22(28)29/h1-11H,12H2,(H,23,25)(H,26,27)(H,28,29)