Vitas-M small molecule compound
7-[(4-bromo-2,6-dimethylphenyl)carbamoyl]tricyclo[3.2.2.0~2,4~]non-8-ene-6-carboxylic acid
Catalog ID
STK389342
SMILES O=C(C1C2C=CC(C1C(=O)O)C1C2C1)Nc1c(C)cc(cc1C)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 C19H20BrNO3 MW 390.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO3/c1-8-5-10(20)6-9(2)17(8)21-18(22)15-11-3-4-12(14-7-13(11)14)16(15)19(23)24/h3-6,11-16H,7H2,1-2H3,(H,21,22)(H,23,24)InChIKey
PBSDNHFROFWOEU-UHFFFAOYSA-NSynonyms
7((4bromo26dimethylphenyl)carbamoyl)tricyclo(3220~24~)non8ene6carboxylicacid
CC1=CC(=CC(=C1NC(=O)C2C3C=CC(C2C(=O)O)C4C3C4)C)Br
InChI=1SC19H20BrNO3c18510(20)69(2)17(8)2118(22)15113412(14713(11)14)16(15)19(23)24h361116H7H212H3(H2122)(H2324)
MFCD03837304
ZINC000169619152
ZINC000239173999
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