4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 4-(hydroxymethyl)-7-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 4-methyl-7-methylol-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C10H13NO3 MolecularWeight: 195.21512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2C1C(=O)NC2=O)CO

Isomeric SMILES

CC1C=CC(C2C1C(=O)NC2=O)CO

InChI

InChI=1S/C10H13NO3/c1-5-2-3-6(4-12)8-7(5)9(13)11-10(8)14/h2-3,5-8,12H,4H2,1H3,(H,11,13,14)