Vitas-M small molecule compound

propyl 4-{[7-(cyanomethoxy)-2-methyl-4-oxo-4H-chromen-3-yl]oxy}benzoate

Catalog ID
STK924719
SMILES CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OCC#N

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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 C22H19NO6 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO6/c1-3-11-27-22(25)15-4-6-16(7-5-15)29-21-14(2)28-19-13-17(26-12-10-23)8-9-18(19)20(21)24/h4-9,13H,3,11-12H2,1-2H3
InChIKey
BDDVOSSPTYMBMX-UHFFFAOYSA-N
Synonyms
847365-83-7
847365837
CCCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC#N)C
InChI=1SC22H19NO6c13112722(25)154616(7515)292114(2)28191317(26121023)8918(19)20(21)24h4913H31112H212H3
MFCD04180551
propyl4((7(cyanomethoxy)2methyl4oxo4Hchromen3yl)oxy)benzoate
PROPYL4(7(CYANOMETHOXY)2METHYL4OXOCHROMEN3YL)OXYBENZOATE
ZINC000002222681
ZINC02222681
ZINC2222681

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Available files

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