Vitas-M small molecule compound
2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
Catalog ID
STK709998
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2C1C1C=CC2C21CC2
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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 C17H14N2O4 MW 310.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O4/c20-15-13-11-4-5-12(17(11)6-7-17)14(13)16(21)18(15)9-2-1-3-10(8-9)19(22)23/h1-5,8,11-14H,6-7H2InChIKey
AVTTZUXWWZWWCH-UHFFFAOYSA-NSynonyms
(3aR4R7S7aS)2(3nitrophenyl)3a477atetrahydro1Hspiro(47methanoisoindole81cyclopropane)13(2H)dione
2(3nitrophenyl)3a477atetrahydro1Hspiro(2aza47methanoisoindole81cyclopropane)13(2H)dione
C1CC12C3C=CC2C4C3C(=O)N(C4=O)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC17H14N2O4c201513114512(17(11)6717)14(13)16(21)18(15)921310(89)19(22)23h1581114H67H2
MFCD00843752
O=C1N(c2cccc(c2)(N+)(=O)(O))C(=O)C2C1C1C=CC2C21CC2
ZINC000239274892
ZINC000239274894
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