Vitas-M small molecule compound
4-chloro-N-{7-[hydroxy(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}benzamide
Catalog ID
STK299366
SMILES COc1ccc(cc1)C(c1cc2OCCOc2cc1NC(=O)c1ccc(cc1)Cl)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 C23H20ClNO5 MW 425.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClNO5/c1-28-17-8-4-14(5-9-17)22(26)18-12-20-21(30-11-10-29-20)13-19(18)25-23(27)15-2-6-16(24)7-3-15/h2-9,12-13,22,26H,10-11H2,1H3,(H,25,27)InChIKey
HKOODBATRGWRRN-UHFFFAOYSA-NSynonyms
4chloroN(7(hydroxy(4methoxyphenyl)methyl)23dihydro14benzodioxin6yl)benzamide
COC1=CC=C(C=C1)C(C2=CC3=C(C=C2NC(=O)C4=CC=C(C=C4)Cl)OCCO3)O
InChI=1SC23H20ClNO5c128178414(5917)22(26)18122021(3011102920)1319(18)2523(27)152616(24)7315h2912132226H1011H21H3(H2527)
MFCD09961304
ZINC000013957427
ZINC000013957429
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