Vitas-M small molecule compound
ethyl 3-{6-chloro-4-methyl-7-[(2-methylnaphthalen-1-yl)methoxy]-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL146132
SMILES CCOC(=O)CCc1c(=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 C27H25ClO5 MW 464.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClO5/c1-4-31-26(29)12-11-19-17(3)21-13-23(28)25(14-24(21)33-27(19)30)32-15-22-16(2)9-10-18-7-5-6-8-20(18)22/h5-10,13-14H,4,11-12,15H2,1-3H3InChIKey
JJOOGHDTHRFQOK-UHFFFAOYSA-NSynonyms
842959-03-9842959039
CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=C(C=CC4=CC=CC=C43)C)Cl)C
ethyl3(6chloro4methyl7((2methylnaphthalen1yl)methoxy)2oxo2Hchromen3yl)propanoate
ETHYL3(6CHLORO4METHYL7((2METHYLNAPHTHALEN1YL)METHOXY)2OXOCHROMEN3YL)PROPANOATE
InChI=1SC27H25ClO5c143126(29)12111917(3)211323(28)25(1424(21)3327(19)30)32152216(2)91018756820(18)22h5101314H4111215H213H3
MFCD04012246
ZINC000002403366
ZINC02403366
ZINC2403366
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