Vitas-M small molecule compound
(3E)-3-[2-(3-bromophenyl)-2-oxoethylidene]-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STK855935
SMILES Brc1cccc(c1)C(=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 C17H12BrNO3 MW 358.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrNO3/c1-10-5-6-16-13(7-10)19-14(17(21)22-16)9-15(20)11-3-2-4-12(18)8-11/h2-9,19H,1H3/b14-9+InChIKey
ZGGCXXSRNRIUHB-NTEUORMPSA-NSynonyms
(3E)3(2(3bromophenyl)2oxoethylidene)6methyl34dihydro2H14benzoxazin2one
(3E)3(2(3BROMOPHENYL)2OXOETHYLIDENE)6METHYL4H14BENZOXAZIN2ONE
(E)3(2(3bromophenyl)2oxoethylidene)6methyl34dihydro2Hbenzo(b)(14)oxazin2one
Brc1cccc(c1)C(=O)C=c1(nH)c2cc(C)ccc2oc1=O
CC1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=CC(=CC=C3)Br)N2
InChI=1SC17H12BrNO3c110561613(710)1914(17(21)2216)915(20)1132412(18)811h2919H1H3b149+
MFCD03304743
ZINC000100820621
ZINC100820621
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