(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

SpectraBase Compound ID	2rdw37d3ps7
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 Google Search
Mol Weight	360.38 g/mol
Molecular Formula	C17H16N2O5S
Exact Mass	360.077993 g/mol

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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
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
Synonyms	8-Nitro-1-methyl-3-phenyl-1,2,3,3a,4,9b-hexahydrobenzo[e][1,2]oxathiino[4,3-b]pyrrole-4,4-dioxide
Wiley ID	1708522