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

Systemtic Name: 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzoate Openeye Name: 4-[2-(1,3-dioxoisoindolin-2-yl)propanoylamino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzoate IUPAC Name: 4-[2-(1,3-dioxoisoindol-2-yl)propanoylamino]benzoate Traditional Name: 4-(2-phthalimidopropanoylamino)benzoate Formula: C18H13N2O5- MolecularWeight: 337.30622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)[O-])N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H14N2O5/c1-10(15(21)19-12-8-6-11(7-9-12)18(24)25)20-16(22)13-4-2-3-5-14(13)17(20)23/h2-10H,1H3,(H,19,21)(H,24,25)/p-1