(4-chloranyl-3,5-dimethyl-phenyl) 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 6-(1,3-dioxoisoindolin-2-yl)hexanoate CAS Name: 6-(1,3-dioxo-2-isoindolyl)hexanoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 6-(1,3-dioxoisoindol-2-yl)hexanoate Traditional Name: 6-phthalimidohexanoic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22ClNO4/c1-14-12-16(13-15(2)20(14)23)28-19(25)10-4-3-7-11-24-21(26)17-8-5-6-9-18(17)22(24)27/h5-6,8-9,12-13H,3-4,7,10-11H2,1-2H3