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

Systemtic Name: 3-[5-(3-azanylphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid Openeye Name: 3-[5-(3-aminophenoxy)-1,3-dioxo-isoindolin-2-yl]benzoic acid CAS Name: 3-[5-(3-aminophenoxy)-1,3-dioxo-2-isoindolyl]benzoic acid IUPAC Name: 3-[5-(3-aminophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid Traditional Name: 3-[5-(3-aminophenoxy)-1,3-diketo-isoindolin-2-yl]benzoic acid Formula: C21H14N2O5 MolecularWeight: 374.34626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)N)C(=O)O

InChI

InChI=1S/C21H14N2O5/c22-13-4-2-6-15(10-13)28-16-7-8-17-18(11-16)20(25)23(19(17)24)14-5-1-3-12(9-14)21(26)27/h1-11H,22H2,(H,26,27)