Vitas-M small molecule compound
6-(4-methoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl 4-nitrobenzoate
Catalog ID
STL510852
SMILES COc1ccc(cc1)c1cc(OC(=O)c2ccc(cc2)[N+](=O)[O-])c2c(c(=O)c1)c(oc2C)C
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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 C25H19NO7 MW 445.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO7/c1-14-23-21(27)12-18(16-6-10-20(31-3)11-7-16)13-22(24(23)15(2)32-14)33-25(28)17-4-8-19(9-5-17)26(29)30/h4-13H,1-3H3InChIKey
OKFUSQYZAJYYSE-UHFFFAOYSA-NSynonyms
716342-61-9(6(4METHOXYPHENYL)13DIMETHYL8OXOCYCLOHEPTA(C)FURAN4YL)4NITROBENZOATE
1285708
6(4methoxyphenyl)13dimethyl4oxo4Hcyclohepta(c)furan8yl4nitrobenzoate
716342619
COc1ccc(cc1)c1cc(OC(=O)c2ccc(cc2)(N+)(=O)(O))c2c(c(=O)c1)c(oc2C)C
InChI=1SC25H19NO7c1142321(27)1218(1661020(313)11716)1322(24(23)15(2)3214)3325(28)174819(9517)26(29)30h413H13H3
MFCD04145133
ZINC000001106320
ZINC1106320
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