Vitas-M small molecule compound
7-[(2-chlorobenzyl)oxy]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-4H-chromen-4-one
Catalog ID
STK888462
SMILES CCc1cc2c(cc1OCc1ccccc1Cl)occ(c2=O)c1ccc2c(c1)OCCCO2
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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 C27H23ClO5 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClO5/c1-2-17-12-20-25(14-24(17)32-15-19-6-3-4-7-22(19)28)33-16-21(27(20)29)18-8-9-23-26(13-18)31-11-5-10-30-23/h3-4,6-9,12-14,16H,2,5,10-11,15H2,1H3InChIKey
VGYORIZAWUROSZ-UHFFFAOYSA-NSynonyms
610761-63-23(2H3H4HBENZO(B)14DIOXEPAN7YL)7((2CHLOROPHENYL)METHOXY)6ETHYLCHROMEN4ONE
610761632
7((2chlorobenzyl)oxy)3(34dihydro2H15benzodioxepin7yl)6ethyl4Hchromen4one
7((2chlorobenzyl)oxy)3(34dihydro2Hbenzo(b)(14)dioxepin7yl)6ethyl4Hchromen4one
7((2CHLOROPHENYL)METHOXY)3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYLCHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=CC=CC=C5Cl
InChI=1SC27H23ClO5c1217122025(1424(17)321519634722(19)28)331621(27(20)29)18892326(1318)31115103023h3469121416H25101115H21H3
MFCD03669890
ZINC000002201103
ZINC02201103
ZINC2201103
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