Vitas-M small molecule compound
(2S,3R)-3-{[3-(trifluoromethyl)phenyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK368758
SMILES O=C([C@@H]1C2C=CC([C@@H]1C(=O)O)C2)Nc1cccc(c1)C(F)(F)F
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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 C16H14F3NO3 MW 325.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3NO3/c17-16(18,19)10-2-1-3-11(7-10)20-14(21)12-8-4-5-9(6-8)13(12)15(22)23/h1-5,7-9,12-13H,6H2,(H,20,21)(H,22,23)/t8?,9?,12-,13+/m1/s1InChIKey
FHZMTPROQINQFA-VCQNEHTGSA-NSynonyms
(2R3S)2((3(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
(2S3R)3((3(trifluoromethyl)phenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
C1C2C=CC1C(C2C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)O
InChI=1SC16H14F3NO3c1716(1819)1021311(710)2014(21)128459(68)13(12)15(22)23h15791213H6H2(H2021)(H2223)t8?9?1213+m1s1
MFCD00401210
O=C((C@@H)1C2C=CC((C@@H)1C(=O)O)C2)Nc1cccc(c1)C(F)(F)F
ZINC000100293279
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