Vitas-M small molecule compound
3-[(2,4-dimethylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK375344
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)Nc1ccc(cc1C)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 C16H17NO4 MW 287.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4/c1-8-3-4-10(9(2)7-8)17-15(18)13-11-5-6-12(21-11)14(13)16(19)20/h3-7,11-14H,1-2H3,(H,17,18)(H,19,20)InChIKey
ZVVJKZOQIXYVMF-UHFFFAOYSA-NSynonyms
500110-66-72((24DIMETHYLPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((24dimethylphenyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(24DIMETHYLPHENYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
500110667
CC1=CC(=C(C=C1)NC(=O)C2C3C=CC(C2C(=O)O)O3)C
InChI=1SC16H17NO4c183410(9(2)78)1715(18)13115612(2111)14(13)16(19)20h371114H12H3(H1718)(H1920)
MFCD01336914
ZINC000169293866
ZINC000245313087
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