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

Systemtic Name: 3-methylbutyl 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]benzoate Openeye Name: isopentyl 4-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]benzoate CAS Name: 4-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]benzoate Traditional Name: 4-(3-phthalimidopropanoylamino)benzoic acid isoamyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H24N2O5/c1-15(2)12-14-30-23(29)16-7-9-17(10-8-16)24-20(26)11-13-25-21(27)18-5-3-4-6-19(18)22(25)28/h3-10,15H,11-14H2,1-2H3,(H,24,26)