2-[3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2-hydroxy-3-piperonyloxy-propyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC(COCC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CC(COCC3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C19H21NO6/c21-13(8-20-18(22)14-3-1-2-4-15(14)19(20)23)10-24-9-12-5-6-16-17(7-12)26-11-25-16/h1-2,5-7,13-15,21H,3-4,8-11H2