| SpectraBase Spectrum ID |
DBpLs1BEoUo |
| Name |
(3aR,8aR,9aR)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2-one |
| Alternate Name(s) |
(3aR,8aR,9aR)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2-one
(3aR,8aR,9aR)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydrobenzo[f][1]benzofuran-2-one
(3aR,8aR,9aR)-5,8a-dimethyl-3-[(4-piperonylpiperazino)methyl]-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H34N2O4 |
| InChI |
InChI=1S/C27H34N2O4/c1-18-4-3-7-27(2)14-25-20(13-22(18)27)21(26(30)33-25)16-29-10-8-28(9-11-29)15-19-5-6-23-24(12-19)32-17-31-23/h4-6,12-13,20-21,25H,3,7-11,14-17H2,1-2H3/t20-,21?,25-,27-/m1/s1 |
| InChIKey |
ZGWLOBCQHKCSSG-JOMNBINVSA-N |
| Molecular Weight |
450.579 g/mol |
| SMILES |
C1(C(O[C@]2([C@@]1(C=C1C(=CCC[C@@]1(C2)C)C)[H])[H])=O)CN1CCN(CC1)Cc1cc2OCOc2cc1 |
| SPLASH |
splash10-052r-7920000000-1a0c7b3fd6e1d456524b |
| Wiley ID |
1445089 |
![(3aR,8aR,9aR)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2-one](/api/spectrum/DBpLs1BEoUo/structure.png?h=300&w=458 "(3aR,8aR,9aR)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2-one")
