Vitas-M small molecule compound
4-[(4Z)-4-(4-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Catalog ID
STK090997
SMILES COc1ccc(cc1)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C(=O)O)C
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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 C19H16N2O4 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O4/c1-12-17(11-13-3-9-16(25-2)10-4-13)18(22)21(20-12)15-7-5-14(6-8-15)19(23)24/h3-11H,1-2H3,(H,23,24)/b17-11-InChIKey
LXMDKDZKQNEHOO-BOPFTXTBSA-NSynonyms
4((4Z)4((4METHOXYPHENYL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOICACID
4((4Z)4(4METHOXYBENZYLIDENE)3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)BENZOICACID
CC1=NN(C(=O)C1=CC2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(=O)O
COc1ccc(cc1)C=C1C(=NN(C1=O)c1ccc(cc1)C(=O)O)C
InChI=1SC19H16N2O4c11217(11133916(252)10413)18(22)21(2012)157514(6815)19(23)24h311H12H3(H2324)b1711
MFCD01828770
STK090997
ZINC000000444719
ZINC444719
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