Vitas-M small molecule compound
(2E)-2-(4-tert-butylbenzylidene)-1-azabicyclo[2.2.2]octan-3-one
Catalog ID
STK665998
SMILES CC(c1ccc(cc1)/C=C\1/N2CCC(C1=O)CC2)(C)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 C18H23NO MW 269.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO/c1-18(2,3)15-6-4-13(5-7-15)12-16-17(20)14-8-10-19(16)11-9-14/h4-7,12,14H,8-11H2,1-3H3/b16-12+InChIKey
FKNRNAOCQXKYEJ-FOWTUZBSSA-NSynonyms
(2E)2((4TERTBUTYLPHENYL)METHYLIDENE)1AZABICYCLO(222)OCTAN3ONE
(2E)2(4tertbutylbenzylidene)1azabicyclo(222)octan3one
2(1(4TERTBUTYLPHENYL)METH(E)YLIDENE)1AZABICYCLO(222)OCTAN3ONE
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)C3CCN2CC3
CC(c1ccc(cc1)C=C1N2CCC(C1=O)CC2)(C)C
InChI=1SC18H23NOc118(23)156413(5715)121617(20)1481019(16)11914h471214H811H213H3b1612+
MFCD05258905
ZINC000032459149
ZINC32459149
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