2-(2-oxidanyl-3-phenoxy-propyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(2-oxidanyl-3-phenoxy-propyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(2-hydroxy-3-phenoxy-propyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(2-hydroxy-3-phenoxypropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(2-hydroxy-3-phenoxypropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(2-hydroxy-3-phenoxy-propyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=O)N(C2=O)CC(COC3=CC=CC=C3)O

Isomeric SMILES

C1CCC2C(C1)C(=O)N(C2=O)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C17H21NO4/c19-12(11-22-13-6-2-1-3-7-13)10-18-16(20)14-8-4-5-9-15(14)17(18)21/h1-3,6-7,12,14-15,19H,4-5,8-11H2