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

Systemtic Name: 4-[5-(2-methoxyphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid Openeye Name: 4-[5-(2-methoxyphenoxy)-1,3-dioxo-isoindolin-2-yl]benzoic acid CAS Name: 4-[5-(2-methoxyphenoxy)-1,3-dioxo-2-isoindolyl]benzoic acid IUPAC Name: 4-[5-(2-methoxyphenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid Traditional Name: 4-[1,3-diketo-5-(2-methoxyphenoxy)isoindolin-2-yl]benzoic acid Formula: C22H15NO6 MolecularWeight: 389.3576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H15NO6/c1-28-18-4-2-3-5-19(18)29-15-10-11-16-17(12-15)21(25)23(20(16)24)14-8-6-13(7-9-14)22(26)27/h2-12H,1H3,(H,26,27)