Vitas-M small molecule compound

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

Catalog ID
STK847835
SMILES N#CCOc1ccc2c(c1)occ(c2=O)Oc1ccc(cc1)C(=O)OCC

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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 C20H15NO6 MW 365.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15NO6/c1-2-24-20(23)13-3-5-14(6-4-13)27-18-12-26-17-11-15(25-10-9-21)7-8-16(17)19(18)22/h3-8,11-12H,2,10H2,1H3
InChIKey
ZZVAQPGDNNDKDI-UHFFFAOYSA-N
Synonyms
637751-45-2
637751452
CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC#N
ethyl4((7(cyanomethoxy)4oxo4Hchromen3yl)oxy)benzoate
ETHYL4(7(CYANOMETHOXY)4OXOCHROMEN3YL)OXYBENZOATE
ETHYL4(7(CYANOMETHOXY)4OXOCHROMEN3YLOXY)BENZOATE
InChI=1SC20H15NO6c122420(23)133514(6413)27181226171115(2510921)7816(17)19(18)22h381112H210H21H3
MFCD04148209
ZINC000002078007
ZINC02078007
ZINC2078007

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Available files

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