Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)prop-2-enamide
Catalog ID
STK237508
SMILES O=C(Nc1cc(C)cc(c1)C)/C=C/c1ccc2c(c1)OCO2
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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 C18H17NO3 MW 295.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO3/c1-12-7-13(2)9-15(8-12)19-18(20)6-4-14-3-5-16-17(10-14)22-11-21-16/h3-10H,11H2,1-2H3,(H,19,20)/b6-4+InChIKey
BRUGSKZHGSOVQQ-GQCTYLIASA-NSynonyms
349417-44-3(2E)3(13benzodioxol5yl)N(35dimethylphenyl)prop2enamide
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)N(35DIMETHYLPHENYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(35DIMETHYLPHENYL)PROP2ENAMIDE
(E)3BENZO(13)DIOXOL5YLN(35DIMETHYLPHENYL)ACRYLAMIDE
349417443
CC1=CC(=CC(=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C
InChI=1SC18H17NO3c112713(2)915(812)1918(20)6414351617(1014)22112116h310H11H212H3(H1920)b64+
MFCD00705557
O=C(Nc1cc(C)cc(c1)C)C=Cc1ccc2c(c1)OCO2
ZINC000003069635
ZINC03069635
ZINC3069635
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