2-[3-[4-(5-fluoranyl-2-propan-2-yloxy-phenyl)piperazin-1-yl]-2-oxidanyl-propyl]-5-oxidanyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-[3-[4-(5-fluoranyl-2-propan-2-yloxy-phenyl)piperazin-1-yl]-2-oxidanyl-propyl]-5-oxidanyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-[3-[4-(5-fluoro-2-isopropoxy-phenyl)piperazin-1-yl]-2-hydroxy-propyl]-5-hydroxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-[3-[4-(5-fluoro-2-propan-2-yloxyphenyl)-1-piperazinyl]-2-hydroxypropyl]-5-hydroxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-[3-[4-(5-fluoro-2-propan-2-yloxyphenyl)piperazin-1-yl]-2-hydroxypropyl]-5-hydroxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-[3-[4-(5-fluoro-2-isopropoxy-phenyl)piperazino]-2-hydroxy-propyl]-5-hydroxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C24H34FN3O5 MolecularWeight: 463.542263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)F)N2CCN(CC2)CC(CN3C(=O)C4CCC(CC4C3=O)O)O

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)F)N2CCN(CC2)CC(CN3C(=O)C4CCC(CC4C3=O)O)O

InChI

InChI=1S/C24H34FN3O5/c1-15(2)33-22-6-3-16(25)11-21(22)27-9-7-26(8-10-27)13-18(30)14-28-23(31)19-5-4-17(29)12-20(19)24(28)32/h3,6,11,15,17-20,29-30H,4-5,7-10,12-14H2,1-2H3