Vitas-M small molecule compound

2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]-5-[(4-nitrobenzyl)oxy]phenol

Catalog ID
STK607630
SMILES Oc1cc(OCc2ccc(cc2)[N+](=O)[O-])ccc1c1[nH]ncc1c1ccc2c(c1)OCCO2

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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 C24H19N3O6 MW 445.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O6/c28-21-12-18(33-14-15-1-4-17(5-2-15)27(29)30)6-7-19(21)24-20(13-25-26-24)16-3-8-22-23(11-16)32-10-9-31-22/h1-8,11-13,28H,9-10,14H2,(H,25,26)
InChIKey
NFQWTYCNWFQIHD-UHFFFAOYSA-N
Synonyms
1010867-51-2
1010867512
2(4(23dihydro14benzodioxin6yl)1Hpyrazol5yl)5((4nitrobenzyl)oxy)phenol
2(4(23dihydrobenzo(b)(14)dioxin6yl)1Hpyrazol3yl)5((4nitrobenzyl)oxy)phenol
MFCD08734503
Oc1cc(OCc2ccc(cc2)(N+)(=O)(O))ccc1c1(nH)ncc1c1ccc2c(c1)OCCO2
Oc1cc(OCc2ccc(cc2)(N+)(=O)(O))ccc1c1n(nH)cc1c1ccc2c(c1)OCCO2
ZINC000009130614

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Available files

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