Vitas-M small molecule compound
(3E)-3-[2-(2,4-dimethoxyphenyl)-2-oxoethylidene]-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STL442889
SMILES COc1cc(OC)ccc1C(=O)/C=c\1/[nH]c2cc(C)ccc2oc1=O
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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 C19H17NO5 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5/c1-11-4-7-17-14(8-11)20-15(19(22)25-17)10-16(21)13-6-5-12(23-2)9-18(13)24-3/h4-10,20H,1-3H3/b15-10+InChIKey
BWDPWQFORQWOSX-XNTDXEJSSA-NSynonyms
(3E)3(2(24dimethoxyphenyl)2oxoethylidene)6methyl34dihydro2H14benzoxazin2one
(3E)3(2(24dimethoxyphenyl)2oxoethylidene)6methyl4H14benzoxazin2one
CC1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=C(C=C(C=C3)OC)OC)N2
COc1cc(OC)ccc1C(=O)C=c1(nH)c2cc(C)ccc2oc1=O
InChI=1SC19H17NO5c111471714(811)2015(19(22)2517)1016(21)136512(232)918(13)243h41020H13H3b1510+
MFCD14741884
ZINC000101355701
ZINC101355701
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