2-methylpropyl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]benzoate Openeye Name: isobutyl 4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]benzoate CAS Name: 4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]benzoate Traditional Name: 4-(6-phthalimidohexanoylamino)benzoic acid isobutyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C25H28N2O5/c1-17(2)16-32-25(31)18-11-13-19(14-12-18)26-22(28)10-4-3-7-15-27-23(29)20-8-5-6-9-21(20)24(27)30/h5-6,8-9,11-14,17H,3-4,7,10,15-16H2,1-2H3,(H,26,28)