4-[4-[[3-(4-nitrophenoxy)phenyl]carbonylamino]phenoxy]phthalic acid

Systemtic Name: 4-[4-[[3-(4-nitrophenoxy)phenyl]carbonylamino]phenoxy]phthalic acid Openeye Name: 4-[4-[[3-(4-nitrophenoxy)benzoyl]amino]phenoxy]phthalic acid CAS Name: 4-[4-[[[3-(4-nitrophenoxy)phenyl]-oxomethyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[4-[[3-(4-nitrophenoxy)benzoyl]amino]phenoxy]phthalic acid Traditional Name: 4-[4-[[3-(4-nitrophenoxy)benzoyl]amino]phenoxy]phthalic acid Formula: C27H18N2O9 MolecularWeight: 514.43982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)OC4=CC(=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)OC4=CC(=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C27H18N2O9/c30-25(16-2-1-3-21(14-16)37-20-10-6-18(7-11-20)29(35)36)28-17-4-8-19(9-5-17)38-22-12-13-23(26(31)32)24(15-22)27(33)34/h1-15H,(H,28,30)(H,31,32)(H,33,34)