4-[3-[2-(3-nitrophenoxy)ethanoylamino]phenoxy]phthalate

Systemtic Name: 4-[3-[2-(3-nitrophenoxy)ethanoylamino]phenoxy]phthalate Openeye Name: 4-[3-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]phthalate CAS Name: 4-[3-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]phenoxy]phthalate IUPAC Name: 4-[3-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]phthalate Traditional Name: 4-[3-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]phthalate Formula: C22H14N2O9-2 MolecularWeight: 450.35456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

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