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

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-methylbutanoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 2-(1,3-dioxoisoindol-2-yl)-3-methylbutanoate Traditional Name: 3-methyl-2-phthalimido-butyric acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(=O)C(C(C)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20ClNO4/c1-11(2)18(21(26)27-14-9-12(3)17(22)13(4)10-14)23-19(24)15-7-5-6-8-16(15)20(23)25/h5-11,18H,1-4H3