4-[[1,3,4-tris(oxidanylidene)-5H-isoindol-5-yl]methyl]benzoic acid

Systemtic Name: 4-[[1,3,4-tris(oxidanylidene)-5H-isoindol-5-yl]methyl]benzoic acid Openeye Name: 4-[(1,3,4-trioxo-5H-isoindol-5-yl)methyl]benzoic acid CAS Name: 4-[(1,3,4-trioxo-5H-isoindol-5-yl)methyl]benzoic acid IUPAC Name: 4-[(1,3,4-trioxo-5H-isoindol-5-yl)methyl]benzoic acid Traditional Name: 4-[(1,3,4-triketo-5H-isoindol-5-yl)methyl]benzoic acid Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)C1CC3=CC=C(C=C3)C(=O)O)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=O)C1CC3=CC=C(C=C3)C(=O)O)C(=O)NC2=O

InChI

InChI=1S/C16H11NO5/c18-13-10(5-6-11-12(13)15(20)17-14(11)19)7-8-1-3-9(4-2-8)16(21)22/h1-6,10H,7H2,(H,21,22)(H,17,19,20)