2-(hydroxymethyl)-3a,4,5,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(hydroxymethyl)-3a,4,5,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(hydroxymethyl)-3a,4,5,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(hydroxymethyl)-3a,4,5,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(hydroxymethyl)-3a,4,5,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-methylol-3a,4,5,7a-tetrahydroisoindole-1,3-quinone Formula: C9H11NO3 MolecularWeight: 181.18854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C=C1)C(=O)N(C2=O)CO

Isomeric SMILES

C1CC2C(C=C1)C(=O)N(C2=O)CO

InChI

InChI=1S/C9H11NO3/c11-5-10-8(12)6-3-1-2-4-7(6)9(10)13/h1,3,6-7,11H,2,4-5H2