methyl 2-methyl-3-[[2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-methyl-3-[[2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(2-isobutyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-2-methyl-benzoate CAS Name: 2-methyl-3-[[[2-(2-methylpropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[[2-(2-methylpropyl)-1,3-dioxoisoindole-5-carbonyl]amino]benzoate Traditional Name: 3-[(2-isobutyl-1,3-diketo-isoindoline-5-carbonyl)amino]-2-methyl-benzoic acid methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC(C)C)C(=O)OC

InChI

InChI=1S/C22H22N2O5/c1-12(2)11-24-20(26)16-9-8-14(10-17(16)21(24)27)19(25)23-18-7-5-6-15(13(18)3)22(28)29-4/h5-10,12H,11H2,1-4H3,(H,23,25)