[1-[[3,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate

Systemtic Name: [1-[[3,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate Openeye Name: [2-(3,5-dichloroanilino)-1-methyl-2-oxo-ethyl] 2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylpentanoic acid [1-(3,5-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,5-dichloroanilino)-1-oxopropan-2-yl] 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate Traditional Name: 4-methyl-2-phthalimido-valeric acid [2-(3,5-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H22Cl2N2O5 MolecularWeight: 477.33718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CC(C(=O)OC(C)C(=O)NC1=CC(=CC(=C1)Cl)Cl)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H22Cl2N2O5/c1-12(2)8-19(27-21(29)17-6-4-5-7-18(17)22(27)30)23(31)32-13(3)20(28)26-16-10-14(24)9-15(25)11-16/h4-7,9-13,19H,8H2,1-3H3,(H,26,28)