Vitas-M small molecule compound
methyl {4-methyl-7-[(4-nitrobenzyl)oxy]-2-oxo-2H-chromen-3-yl}acetate
Catalog ID
STK829468
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)[N+](=O)[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 C20H17NO7 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO7/c1-12-16-8-7-15(27-11-13-3-5-14(6-4-13)21(24)25)9-18(16)28-20(23)17(12)10-19(22)26-2/h3-9H,10-11H2,1-2H3InChIKey
QVHSHWFFASTYDI-UHFFFAOYSA-NSynonyms
577980-76-8577980768
CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))CC(=O)OC
COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H17NO7c112168715(2711133514(6413)21(24)25)918(16)2820(23)17(12)1019(22)262h39H1011H212H3
methyl(4methyl7((4nitrobenzyl)oxy)2oxo2Hchromen3yl)acetate
methyl2(4methyl7((4nitrobenzyl)oxy)2oxo2Hchromen3yl)acetate
METHYL2(4METHYL7((4NITROPHENYL)METHOXY)2OXOCHROMEN3YL)ACETATE
MFCD04021452
ZINC000005063021
ZINC05063021
ZINC5063021
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