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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(diethylamino)benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-(diethylamino)benzoate CAS Name: 4-(diethylamino)benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-(diethylamino)benzoate Traditional Name: 4-(diethylamino)benzoic acid 2-phthalimidoethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O4/c1-3-22(4-2)16-11-9-15(10-12-16)21(26)27-14-13-23-19(24)17-7-5-6-8-18(17)20(23)25/h5-12H,3-4,13-14H2,1-2H3