Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-ethyl-4-oxo-4H-chromen-7-yl 4-nitrobenzoate
Catalog ID
STK888875
SMILES CCc1cc2c(cc1OC(=O)c1ccc(cc1)[N+](=O)[O-])occ(c2=O)c1ccc2c(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 C26H19NO8 MW 473.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19NO8/c1-2-15-11-19-23(13-22(15)35-26(29)16-3-6-18(7-4-16)27(30)31)34-14-20(25(19)28)17-5-8-21-24(12-17)33-10-9-32-21/h3-8,11-14H,2,9-10H2,1H3InChIKey
CUFZYZRIHCCTGT-UHFFFAOYSA-NSynonyms
610753-49-6(3(23DIHYDRO14BENZODIOXIN6YL)6ETHYL4OXOCHROMEN7YL)4NITROBENZOATE
3(23dihydro14benzodioxin6yl)6ethyl4oxo4Hchromen7yl4nitrobenzoate
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)6ETHYL4OXO4HCHROMEN7YL4NITROBENZOATE
3(2H3HBENZO(34E)14DIOXAN6YL)6ETHYL4OXOCHROMEN7YL4NITROBENZOATE
610753496
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OC(=O)C5=CC=C(C=C5)(N+)(=O)(O)
CCc1cc2c(cc1OC(=O)c1ccc(cc1)(N+)(=O)(O))occ(c2=O)c1ccc2c(c1)OCCO2
InChI=1SC26H19NO8c1215111923(1322(15)3526(29)163618(7416)27(30)31)341420(25(19)28)17582124(1217)331093221h381114H2910H21H3
MFCD03851711
ZINC000001132494
ZINC01132494
ZINC1132494
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