Vitas-M small molecule compound
2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK080599
SMILES O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2C1C1CCC2C=C1
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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 C16H14N2O4 MW 298.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O4/c19-15-13-9-4-5-10(7-6-9)14(13)16(20)17(15)11-2-1-3-12(8-11)18(21)22/h1-5,8-10,13-14H,6-7H2InChIKey
FRSVFUDGZCTKMB-UHFFFAOYSA-NSynonyms
2(3NITROPHENYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13(2H)DIONE
C1CC2C=CC1C3C2C(=O)N(C3=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC16H14N2O4c19151394510(769)14(13)16(20)17(15)1121312(811)18(21)22h158101314H67H2
MFCD01067481
O=C1N(c2cccc(c2)(N+)(=O)(O))C(=O)C2C1C1CCC2C=C1
STK080599
ZINC000100636425
ZINC000103140707
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