Vitas-M small molecule compound
(2E)-4-[(4-fluoro-3-nitrophenyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK331296
SMILES O=C(Nc1ccc(c(c1)[N+](=O)[O-])F)/C=C/C(=O)O
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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 C10H7FN2O5 MW 254.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H7FN2O5/c11-7-2-1-6(5-8(7)13(17)18)12-9(14)3-4-10(15)16/h1-5H,(H,12,14)(H,15,16)/b4-3+InChIKey
TUPOUSSKZNAZQW-ONEGZZNKSA-NSynonyms
(2E)3(N(4FLUORO3NITROPHENYL)CARBAMOYL)PROP2ENOICACID
(2E)4((4fluoro3nitrophenyl)amino)4oxobut2enoicacid
(E)4(4FLUORO3NITROANILINO)4OXOBUT2ENOICACID
C1=CC(=C(C=C1NC(=O)C=CC(=O)O)(N+)(=O)(O))F
InChI=1SC10H7FN2O5c117216(58(7)13(17)18)129(14)3410(15)16h15H(H1214)(H1516)b43+
MFCD00587688
O=C(Nc1ccc(c(c1)(N+)(=O)(O))F)C=CC(=O)O
ZINC000002740627
ZINC2740627
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