Vitas-M small molecule compound
(2E)-3-(4-fluorophenyl)-1-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]prop-2-en-1-one
Catalog ID
STL303236
SMILES Fc1ccc(cc1)/C=C/C(=O)N1CC[C@@]2([C@H](C1)CCCC2)O
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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 C18H22FNO2 MW 303.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22FNO2/c19-16-7-4-14(5-8-16)6-9-17(21)20-12-11-18(22)10-2-1-3-15(18)13-20/h4-9,15,22H,1-3,10-13H2/b9-6+/t15-,18-/m0/s1InChIKey
DKZWGWFIHJSOAQ-BJSLICBWSA-NSynonyms
(2E)3(4fluorophenyl)1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)prop2en1one
(E)1((4aS8aS)4ahydroxy13456788aoctahydroisoquinolin2yl)3(4fluorophenyl)prop2en1one
(E)3(4fluorophenyl)1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)prop2en1one
(E)3(4FLUOROPHENYL)1((4AS8AS)4AHYDROXYOCTAHYDROISOQUINOLIN2YL)PROPENONE
C1CCC2(CCN(CC2C1)C(=O)C=CC3=CC=C(C=C3)F)O
Fc1ccc(cc1)C=CC(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O
InChI=1SC18H22FNO2c19167414(5816)6917(21)20121118(22)1021315(18)1320h491522H131013H2b96+t1518m0s1
ZINC000005478159
ZINC05478159
ZINC5478159
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