Vitas-M small molecule compound
5a,6,6,8-tetramethyl-2-nitro-5a,6-dihydro-12H-indolo[2,1-b][1,3]benzoxazine
Catalog ID
STL328793
SMILES Cc1ccc2c(c1)C(C)(C)C1(N2Cc2c(O1)ccc(c2)[N+](=O)[O-])C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H20N2O3 MW 324.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3/c1-12-5-7-16-15(9-12)18(2,3)19(4)20(16)11-13-10-14(21(22)23)6-8-17(13)24-19/h5-10H,11H2,1-4H3InChIKey
NJLPYVTXWBLNJW-UHFFFAOYSA-NSynonyms
(R)5a668tetramethyl2nitro612dihydro5aHbenzo(56)(13)oxazino(32a)indole
5A668TETRAMETHYL2NITRO12HINDOLO(21B)(13)BENZOXAZINE
5a668tetramethyl2nitro5a6dihydro12Hindolo(21b)(13)benzoxazine
CC1=CC2=C(C=C1)N3CC4=C(C=CC(=C4)(N+)(=O)(O))OC3(C2(C)C)C
Cc1ccc2c(c1)C(C)(C)(C@@)1(N2Cc2c(O1)ccc(c2)(N+)(=O)(O))C
Cc1ccc2c(c1)C(C)(C)C1(N2Cc2c(O1)ccc(c2)(N+)(=O)(O))C
InChI=1SC19H20N2O3c112571615(912)18(23)19(4)20(16)11131014(21(22)23)6817(13)2419h510H11H214H3
MFCD01106003
ZINC000004817379
ZINC000005337705
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