Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(cyclohexylmethyl)prop-2-enamide
Catalog ID
STK489479
SMILES O=C(/C=C/c1ccc2c(c1)OCO2)NCC1CCCCC1
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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 C17H21NO3 MW 287.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3/c19-17(18-11-14-4-2-1-3-5-14)9-7-13-6-8-15-16(10-13)21-12-20-15/h6-10,14H,1-5,11-12H2,(H,18,19)/b9-7+InChIKey
CLKHGNJQRGHHGB-VQHVLOKHSA-NSynonyms
(2E)3(13benzodioxol5yl)N(cyclohexylmethyl)prop2enamide
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)N(CYCLOHEXYLMETHYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(CYCLOHEXYLMETHYL)PROP2ENAMIDE
C1CCC(CC1)CNC(=O)C=CC2=CC3=C(C=C2)OCO3
InChI=1SC17H21NO3c1917(1811144213514)9713681516(1013)21122015h61014H151112H2(H1819)b97+
MFCD01430777
O=C(C=Cc1ccc2c(c1)OCO2)NCC1CCCCC1
ZINC000005677823
ZINC05677823
ZINC5677823
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