3-[5-(4-methylphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid

Systemtic Name: 3-[5-(4-methylphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid Openeye Name: 3-[5-(4-methylphenoxy)-1,3-dioxo-isoindolin-2-yl]benzoic acid CAS Name: 3-[5-(4-methylphenoxy)-1,3-dioxo-2-isoindolyl]benzoic acid IUPAC Name: 3-[5-(4-methylphenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid Traditional Name: 3-[1,3-diketo-5-(4-methylphenoxy)isoindolin-2-yl]benzoic acid Formula: C22H15NO5 MolecularWeight: 373.3582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C22H15NO5/c1-13-5-7-16(8-6-13)28-17-9-10-18-19(12-17)21(25)23(20(18)24)15-4-2-3-14(11-15)22(26)27/h2-12H,1H3,(H,26,27)