Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Catalog ID
STL433927
SMILES O=CN1N=C(CC1c1ccc(cc1)OC)c1ccc2c(c1)OCO2
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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 C18H16N2O4 MW 324.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4/c1-22-14-5-2-12(3-6-14)16-9-15(19-20(16)10-21)13-4-7-17-18(8-13)24-11-23-17/h2-8,10,16H,9,11H2,1H3InChIKey
DWXSAVXAEOULJV-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)5(4methoxyphenyl)45dihydro1Hpyrazole1carbaldehyde
5(13benzodioxol5yl)3(4methoxyphenyl)34dihydropyrazole2carbaldehyde
COC1=CC=C(C=C1)C2CC(=NN2C=O)C3=CC4=C(C=C3)OCO4
InChI=1SC18H16N2O4c122145212(3614)16915(1920(16)1021)13471718(813)24112317h281016H911H21H3
MFCD26098185
ZINC000078549309
ZINC000078549314
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