Vitas-M small molecule compound
2-[2-(difluoromethyl)-9,10-dimethoxy-6,6-dimethyl-6,7-dihydropyrido[2,1-a]isoquinolinium-4-yl]-4-nitrophenolate
Catalog ID
STL440318
SMILES COc1cc2CC(C)(C)[n+]3c(c2cc1OC)cc(cc3c1cc(ccc1[O-])[N+](=O)[O-])C(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 C24H22F2N2O5 MW 456.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22F2N2O5/c1-24(2)12-14-9-21(32-3)22(33-4)11-16(14)18-7-13(23(25)26)8-19(27(18)24)17-10-15(28(30)31)5-6-20(17)29/h5-11,23H,12H2,1-4H3InChIKey
ADDHJFVNSLKQIP-UHFFFAOYSA-NSynonyms
2(2(DIFLUOROMETHYL)66DIMETHYL910DIMETHOXY67DIHYDROBENZO(A)QUINOLIZINIUM4YL)4NITROPHENOLANION
2(2(difluoromethyl)910dimethoxy66dimethyl67dihydropyrido(21a)isoquinolinium4yl)4nitrophenolate
2(2(DIFLUOROMETHYL)910DIMETHOXY66DIMETHYL6H7HPYRIDO(21A)ISOQUINOLINIUM4YL)4NITROBENZENOLATE
6(2(DIFLUOROMETHYL)910DIMETHOXY66DIMETHYL7HBENZO(A)QUINOLIZIN4YLIDENE)4NITROCYCLOHEXA24DIEN1ONE
CC1(CC2=CC(=C(C=C2C3=CC(=CC(=C4C=C(C=CC4=O)(N+)(=O)(O))N31)C(F)F)OC)OC)C
COc1cc2CC(C)(C)(n+)3c(c2cc1OC)cc(cc3c1cc(ccc1(O))(N+)(=O)(O))C(F)F
InChI=1SC24H22F2N2O5c124(2)1214921(323)22(334)1116(14)18713(23(25)26)819(27(18)24)171015(28(30)31)5620(17)29h51123H12H214H3
MFCD06243365
ZINC000003771100
ZINC000025179595
Check stock
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Check stock on Vitas-MAvailable files
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