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

Systemtic Name: propyl 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzoate Openeye Name: propyl 4-[2-(1,3-dioxoisoindolin-2-yl)propanoylamino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[2-(1,3-dioxoisoindol-2-yl)propanoylamino]benzoate Traditional Name: 4-(2-phthalimidopropanoylamino)benzoic acid propyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O5/c1-3-12-28-21(27)14-8-10-15(11-9-14)22-18(24)13(2)23-19(25)16-6-4-5-7-17(16)20(23)26/h4-11,13H,3,12H2,1-2H3,(H,22,24)