Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-6,7-dimethyl-4-oxo-4H-chromene-2-carboxamide

Catalog ID
STK911235
SMILES O=C(c1cc(=O)c2c(o1)cc(c(c2)C)C)NCc1ccc2c(c1)OCO2

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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 C20H17NO5 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5/c1-11-5-14-15(22)8-19(26-17(14)6-12(11)2)20(23)21-9-13-3-4-16-18(7-13)25-10-24-16/h3-8H,9-10H2,1-2H3,(H,21,23)
InChIKey
CXHVIRWVWIRGTK-UHFFFAOYSA-N
Synonyms
873080-99-0
873080990
CC1=C(C=C2C(=C1)C(=O)C=C(O2)C(=O)NCC3=CC4=C(C=C3)OCO4)C
InChI=1SC20H17NO5c11151415(22)819(2617(14)612(11)2)20(23)21913341618(713)25102416h38H910H212H3(H2123)
MFCD07426151
N(13benzodioxol5ylmethyl)67dimethyl4oxo4Hchromene2carboxamide
N(13benzodioxol5ylmethyl)67dimethyl4oxochromene2carboxamide
ZINC000006811401
ZINC06811401
ZINC6811401

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.