Vitas-M small molecule compound
3-[(2-bromo-4-methylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK474890
SMILES O=C(C1C2CCC(C1C(=O)O)O2)Nc1ccc(cc1Br)C
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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 C15H16BrNO4 MW 354.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrNO4/c1-7-2-3-9(8(16)6-7)17-14(18)12-10-4-5-11(21-10)13(12)15(19)20/h2-3,6,10-13H,4-5H2,1H3,(H,17,18)(H,19,20)InChIKey
NLDSSGYILWJOCN-UHFFFAOYSA-NSynonyms
2((2BROMO4METHYLPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPTANE3CARBOXYLICACID
3(((2BROMO4METHYLPHENYL)AMINO)CARBONYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
3((2bromo4methylphenyl)carbamoyl)7oxabicyclo(221)heptane2carboxylicacid
3(N(2BROMO4METHYLPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPTANE2CARBOXYLICACID
CC1=CC(=C(C=C1)NC(=O)C2C3CCC(C2C(=O)O)O3)Br
InChI=1SC15H16BrNO4c17239(8(16)67)1714(18)12104511(2110)13(12)15(19)20h2361013H45H21H3(H1718)(H1920)
MFCD06067543
ZINC000168182056
ZINC000169299101
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