Vitas-M small molecule compound
3-[(2-fluoro-5-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK419993
SMILES O=C(C1C2C=CC(C1C(=O)O)C2)Nc1cc(C)ccc1F
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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 C16H16FNO3 MW 289.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16FNO3/c1-8-2-5-11(17)12(6-8)18-15(19)13-9-3-4-10(7-9)14(13)16(20)21/h2-6,9-10,13-14H,7H2,1H3,(H,18,19)(H,20,21)InChIKey
DJPLHWZVYZHSBS-UHFFFAOYSA-NSynonyms
1052549-86-61052549866
2((2fluoro5methylphenyl)carbamoyl)bicyclo(221)hept5ene3carboxylicacid
3((2fluoro5methylphenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
CC1=CC(=C(C=C1)F)NC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC16H16FNO3c182511(17)12(68)1815(19)1393410(79)14(13)16(20)21h269101314H7H21H3(H1819)(H2021)
MFCD06059334
ZINC000102177873
ZINC000239038536
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