Vitas-M small molecule compound
2-(4-bromophenyl)-2-oxoethyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylate
Catalog ID
STK134130
SMILES O=C1COc2c(N1)cc(cc2)C(=O)OCC(=O)c1ccc(cc1)Br
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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 C17H12BrNO5 MW 390.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrNO5/c18-12-4-1-10(2-5-12)14(20)8-24-17(22)11-3-6-15-13(7-11)19-16(21)9-23-15/h1-7H,8-9H2,(H,19,21)InChIKey
KXFUQSJGIFKYIV-UHFFFAOYSA-NSynonyms
(2(4BROMOPHENYL)2OXOETHYL)3OXO4H14BENZOXAZINE6CARBOXYLATE
2(4BROMOPHENYL)2OXOETHYL3OXO34DIHYDRO2H14BENZOXAZINE6CARBOXYLATE
C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br
InChI=1SC17H12BrNO5c18124110(2512)14(20)82417(22)11361513(711)1916(21)92315h17H89H2(H1921)
MFCD03368439
ZINC000000643474
ZINC00643474
ZINC643474
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