Vitas-M small molecule compound
9-(3-hydroxypropyl)-3-phenyl-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
Catalog ID
STK641681
SMILES OCCCN1COc2c(C1)c1oc(c(c(=O)c1cc2)c1ccccc1)C(F)(F)F
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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 C21H18F3NO4 MW 405.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3NO4/c22-21(23,24)20-17(13-5-2-1-3-6-13)18(27)14-7-8-16-15(19(14)29-20)11-25(12-28-16)9-4-10-26/h1-3,5-8,26H,4,9-12H2InChIKey
XUNCAGDRHITNSZ-UHFFFAOYSA-NSynonyms
1010919-99-91010919999
9(3hydroxypropyl)3phenyl2(trifluoromethyl)810dihydropyrano(23f)(13)benzoxazin4one
9(3HYDROXYPROPYL)3PHENYL2(TRIFLUOROMETHYL)8H10HCHROMENO(87E)13OXAZAPERHYDROIN4ONE
9(3hydroxypropyl)3phenyl2(trifluoromethyl)910dihydro4H8Hchromeno(87e)(13)oxazin4one
9(3HYDROXYPROPYL)3PHENYL2(TRIFLUOROMETHYL)910DIHYDROCHROMENO(87E)(13)OXAZIN4(8H)ONE
C1C2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)OCN1CCCO
InChI=1SC21H18F3NO4c2221(2324)2017(135213613)18(27)14781615(19(14)2920)1125(122816)941026h135826H4912H2
MFCD11999797
ZINC000054313739
ZINC54313739
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