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

Systemtic Name: 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzoic acid Openeye Name: 4-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]benzoic acid CAS Name: 4-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]benzoic acid Traditional Name: 4-(3-phthalimidopropanoylamino)benzoic acid Formula: C18H14N2O5 MolecularWeight: 338.31416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O5/c21-15(19-12-7-5-11(6-8-12)18(24)25)9-10-20-16(22)13-3-1-2-4-14(13)17(20)23/h1-8H,9-10H2,(H,19,21)(H,24,25)