| SpectraBase Spectrum ID |
411DMHSNs4K |
| Name |
(3S,3aS,9bS)-1-Methyl-8-nitro-3-phenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide |
| Alternate Name(s) |
8-Nitro-1-methyl-3-phenyl-1,2,3,3a,4,9b-hexahydrobenzo[e][1,2]oxathiino[4,3-b]pyrrole-4,4-dioxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16N2O5S |
| InChI |
InChI=1S/C17H16N2O5S/c1-18-10-14(11-5-3-2-4-6-11)17-16(18)13-9-12(19(20)21)7-8-15(13)24-25(17,22)23/h2-9,14,16-17H,10H2,1H3/t14-,16+,17+/m1/s1 |
| InChIKey |
GVZRHQNYFCQDBA-PVAVHDDUSA-N |
| Molecular Weight |
360.384 g/mol |
| SMILES |
[C@@]12(S(Oc3ccc(cc3[C@@]2(N(C)C[C@@]1(c1ccccc1)[H])[H])N(=O)=O)(=O)=O)[H] |
| SPLASH |
splash10-0udi-0492000000-12bbe4495a81908f72b6 |
| Source of Spectrum |
F-68-3646-4d |
| Wiley ID |
1708522 |
![(3S,3aS,9bS)-1-Methyl-8-nitro-3-phenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide](/api/spectrum/411DMHSNs4K/structure.png?h=300&w=458 "(3S,3aS,9bS)-1-Methyl-8-nitro-3-phenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide")
