(3-oxidanylidene-1,2-dihydroisoindol-1-yl) 2-(2-diethylaminoethyl)benzoate

Systemtic Name: (3-oxidanylidene-1,2-dihydroisoindol-1-yl) 2-(2-diethylaminoethyl)benzoate Openeye Name: (3-oxoisoindolin-1-yl) 2-(2-diethylaminoethyl)benzoate CAS Name: 2-(2-diethylaminoethyl)benzoic acid (3-oxo-1,2-dihydroisoindol-1-yl) ester IUPAC Name: (3-oxo-1,2-dihydroisoindol-1-yl) 2-(2-diethylaminoethyl)benzoate Traditional Name: 2-(2-diethylaminoethyl)benzoic acid (3-ketoisoindolin-1-yl) ester Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=CC=CC=C1C(=O)OC2C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCN(CC)CCC1=CC=CC=C1C(=O)OC2C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C21H24N2O3/c1-3-23(4-2)14-13-15-9-5-6-10-16(15)21(25)26-20-18-12-8-7-11-17(18)19(24)22-20/h5-12,20H,3-4,13-14H2,1-2H3,(H,22,24)