Vitas-M small molecule compound
(2Z)-2-benzylidene-8-(3-methoxypropyl)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STL099373
SMILES COCCCN1COc2c(C1)c1O/C(=C\c3ccccc3)/C(=O)c1cc2
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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 C21H21NO4 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4/c1-24-11-5-10-22-13-17-18(25-14-22)9-8-16-20(23)19(26-21(16)17)12-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11,13-14H2,1H3/b19-12-InChIKey
IXLFLEIAGLRDGE-UNOMPAQXSA-NSynonyms
(2Z)2benzylidene8(3methoxypropyl)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)2benzylidene8(3methoxypropyl)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(E)2benzylidene8(3methoxypropyl)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
COCCCN1CC2=C(C=CC3=C2OC(=CC4=CC=CC=C4)C3=O)OC1
COCCCN1COc2c(C1)c1OC(=Cc3ccccc3)C(=O)c1cc2
InChI=1SC21H21NO4c1241151022131718(251422)981620(23)19(2621(16)17)12156324715h246912H510111314H21H3b1912
MFCD09986371
ZINC000012442616
ZINC12442616
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