Vitas-M small molecule compound

methyl {6-chloro-4-methyl-7-[(2-methylnaphthalen-1-yl)methoxy]-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STK829444
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OCc1c(C)ccc2c1cccc2)Cl

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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 C25H21ClO5 MW 436.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClO5/c1-14-8-9-16-6-4-5-7-17(16)20(14)13-30-23-12-22-18(10-21(23)26)15(2)19(25(28)31-22)11-24(27)29-3/h4-10,12H,11,13H2,1-3H3
InChIKey
RAZYIPYUBIJNBT-UHFFFAOYSA-N
Synonyms
577770-71-9
577770719
CC1=C(C2=CC=CC=C2C=C1)COC3=C(C=C4C(=C(C(=O)OC4=C3)CC(=O)OC)C)Cl
InChI=1SC25H21ClO5c1148916645717(16)20(14)133023122218(1021(23)26)15(2)19(25(28)3122)1124(27)293h41012H1113H213H3
methyl(6chloro4methyl7((2methylnaphthalen1yl)methoxy)2oxo2Hchromen3yl)acetate
methyl2(6chloro4methyl7((2methylnaphthalen1yl)methoxy)2oxo2Hchromen3yl)acetate
METHYL2(6CHLORO4METHYL7((2METHYLNAPHTHALEN1YL)METHOXY)2OXOCHROMEN3YL)ACETATE
MFCD04019403
ZINC000002856196
ZINC02856196
ZINC2856196

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Available files

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