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

Systemtic Name: 2-methylpropyl 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]benzoate Openeye Name: isobutyl 4-[[2-(1,3-dioxoisoindolin-2-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]benzoate Traditional Name: 4-[(2-phthalimidoacetyl)amino]benzoic acid isobutyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N2O5/c1-13(2)12-28-21(27)14-7-9-15(10-8-14)22-18(24)11-23-19(25)16-5-3-4-6-17(16)20(23)26/h3-10,13H,11-12H2,1-2H3,(H,22,24)