3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]propanoic acid

Systemtic Name: 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]propanoic acid Openeye Name: 3-[4-(1,3-dioxoisoindolin-2-yl)phenoxy]propanoic acid CAS Name: 3-[4-(1,3-dioxo-2-isoindolyl)phenoxy]propanoic acid IUPAC Name: 3-[4-(1,3-dioxoisoindol-2-yl)phenoxy]propanoic acid Traditional Name: 3-(4-phthalimidophenoxy)propionic acid Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)OCCC(=O)O

InChI

InChI=1S/C17H13NO5/c19-15(20)9-10-23-12-7-5-11(6-8-12)18-16(21)13-3-1-2-4-14(13)17(18)22/h1-8H,9-10H2,(H,19,20)