4-[2-tert-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylbenzoic acid

Systemtic Name: 4-[2-tert-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylbenzoic acid Openeye Name: 4-(2-tert-butyl-1,3-dioxo-isoindoline-5-carbonyl)benzoic acid CAS Name: 4-[(2-tert-butyl-1,3-dioxo-5-isoindolyl)-oxomethyl]benzoic acid IUPAC Name: 4-(2-tert-butyl-1,3-dioxoisoindole-5-carbonyl)benzoic acid Traditional Name: 4-(2-tert-butyl-1,3-diketo-isoindoline-5-carbonyl)benzoic acid Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H17NO5/c1-20(2,3)21-17(23)14-9-8-13(10-15(14)18(21)24)16(22)11-4-6-12(7-5-11)19(25)26/h4-10H,1-3H3,(H,25,26)