Vitas-M small molecule compound
(2Z)-1-(3,4-dimethoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Catalog ID
STL565608
SMILES COc1ccc(cc1OC)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2
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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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-25-19-5-4-15(11-20(19)26-2)18(24)13-17-16-12-22-21(27-8-3-9-28-22)10-14(16)6-7-23-17/h4-5,10-13,23H,3,6-9H2,1-2H3/b17-13-InChIKey
WQQJUEHQRDLBOL-LGMDPLHJSA-NSynonyms
904263-01-0(2Z)1(34dimethoxyphenyl)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)ethanone
(2Z)1(34dimethoxyphenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(Z)1(34dimethoxyphenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
16405504
904263010
COc1ccc(cc1OC)C(=O)C=C1NCCc2c1cc1OCCCOc1c2
InChI=1SC22H23NO5c125195415(1120(19)262)18(24)131716122221(278392822)1014(16)672317h45101323H369H212H3b1713
MFCD07637009
ZINC000004090186
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