3-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]carbonylamino]benzoic acid Openeye Name: 3-[(1,3-dioxo-2-phenyl-isoindoline-5-carbonyl)amino]benzoic acid CAS Name: 3-[[(1,3-dioxo-2-phenyl-5-isoindolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(1,3-dioxo-2-phenylisoindole-5-carbonyl)amino]benzoic acid Traditional Name: 3-[(1,3-diketo-2-phenyl-isoindoline-5-carbonyl)amino]benzoic acid Formula: C22H14N2O5 MolecularWeight: 386.35696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C22H14N2O5/c25-19(23-15-6-4-5-14(11-15)22(28)29)13-9-10-17-18(12-13)21(27)24(20(17)26)16-7-2-1-3-8-16/h1-12H,(H,23,25)(H,28,29)