[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-quinolin-2-ylpropanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-quinolin-2-ylpropanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid phthalimidomethyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H16N2O4/c24-19(12-11-15-10-9-14-5-1-4-8-18(14)22-15)27-13-23-20(25)16-6-2-3-7-17(16)21(23)26/h1-10H,11-13H2