(2-chloranylquinolin-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (2-chloro-3-quinolyl)methyl ester Formula: C22H17ClN2O4 MolecularWeight: 408.83438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)COC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17ClN2O4/c23-20-15(12-14-6-1-4-9-18(14)24-20)13-29-19(26)10-5-11-25-21(27)16-7-2-3-8-17(16)22(25)28/h1-4,6-9,12H,5,10-11,13H2