4-[4-benzamido-2-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid

Systemtic Name: 4-[4-benzamido-2-[(3-nitrophenyl)carbonylamino]phenoxy]phthalic acid Openeye Name: 4-[4-benzamido-2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid CAS Name: 4-[4-benzamido-2-[[(3-nitrophenyl)-oxomethyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[4-benzamido-2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid Traditional Name: 4-[4-benzamido-2-[(3-nitrobenzoyl)amino]phenoxy]phthalic acid Formula: C28H19N3O9 MolecularWeight: 541.46516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC3=CC(=C(C=C3)C(=O)O)C(=O)O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC3=CC(=C(C=C3)C(=O)O)C(=O)O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H19N3O9/c32-25(16-5-2-1-3-6-16)29-18-9-12-24(40-20-10-11-21(27(34)35)22(15-20)28(36)37)23(14-18)30-26(33)17-7-4-8-19(13-17)31(38)39/h1-15H,(H,29,32)(H,30,33)(H,34,35)(H,36,37)