2-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(1S)-1-(hydroxymethyl)-2-methyl-propyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(1S)-2-methyl-1-methylol-propyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)N1C(=O)C2=C(C1=O)CCCC2

Isomeric SMILES

CC(C)[C@@H](CO)N1C(=O)C2=C(C1=O)CCCC2

InChI

InChI=1S/C13H19NO3/c1-8(2)11(7-15)14-12(16)9-5-3-4-6-10(9)13(14)17/h8,11,15H,3-7H2,1-2H3/t11-/m1/s1