Vitas-M small molecule compound
(2E)-1-(1-methyl-1H-pyrazol-4-yl)-3-(3-nitrophenyl)prop-2-en-1-one
Catalog ID
STK310509
SMILES Cn1ncc(c1)C(=O)/C=C/c1cccc(c1)[N+](=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 C13H11N3O3 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O3/c1-15-9-11(8-14-15)13(17)6-5-10-3-2-4-12(7-10)16(18)19/h2-9H,1H3/b6-5+InChIKey
NHUQIZNTNYZYGF-AATRIKPKSA-NSynonyms
1005685-55-1(2E)1(1methyl1Hpyrazol4yl)3(3nitrophenyl)prop2en1one
(E)1(1methylpyrazol4yl)3(3nitrophenyl)prop2en1one
1005685551
CN1C=C(C=N1)C(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
Cn1ncc(c1)C(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC13H11N3O3c115911(81415)13(17)651032412(710)16(18)19h29H1H3b65+
MFCD04135854
ZINC000006925527
ZINC06925527
ZINC6925527
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