4-(2-methyl-1-oxidanyl-propan-2-yl)isoindole-1,3-dione

Systemtic Name: 4-(2-methyl-1-oxidanyl-propan-2-yl)isoindole-1,3-dione Openeye Name: 4-(2-hydroxy-1,1-dimethyl-ethyl)isoindoline-1,3-dione CAS Name: 4-(1-hydroxy-2-methylpropan-2-yl)isoindole-1,3-dione IUPAC Name: 4-(1-hydroxy-2-methylpropan-2-yl)isoindole-1,3-dione Traditional Name: 4-(2-hydroxy-1,1-dimethyl-ethyl)isoindoline-1,3-quinone Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C1=CC=CC2=C1C(=O)NC2=O

Isomeric SMILES

CC(C)(CO)C1=CC=CC2=C1C(=O)NC2=O

InChI

InChI=1S/C12H13NO3/c1-12(2,6-14)8-5-3-4-7-9(8)11(16)13-10(7)15/h3-5,14H,6H2,1-2H3,(H,13,15,16)