Vitas-M small molecule compound
[5-(4-chlorophenyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](3-nitrophenyl)methanone
Catalog ID
STK762053
SMILES CC1=NN(C(C1)(O)c1ccc(cc1)Cl)C(=O)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 C17H14ClN3O4 MW 359.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O4/c1-11-10-17(23,13-5-7-14(18)8-6-13)20(19-11)16(22)12-3-2-4-15(9-12)21(24)25/h2-9,23H,10H2,1H3InChIKey
VJCFYPAWKWKTEM-UHFFFAOYSA-NSynonyms
(5(4chlorophenyl)5hydroxy3methyl45dihydro1Hpyrazol1yl)(3nitrophenyl)methanone
(5(4CHLOROPHENYL)5HYDROXY3METHYL4HPYRAZOL1YL)(3NITROPHENYL)METHANONE
CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC(=CC=C3)(N+)(=O)(O)
CC1=NN(C(C1)(O)c1ccc(cc1)Cl)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC17H14ClN3O4c1111017(23135714(18)8613)20(1911)16(22)1232415(912)21(24)25h2923H10H21H3
MFCD01872599
ZINC000000845815
ZINC000000845816
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