Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-[(4-ethylphenyl)amino]prop-2-en-1-one
Catalog ID
STK902218
SMILES CCc1ccc(cc1)N/C=C/C(=O)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/c1-2-13-3-6-15(7-4-13)19-10-9-16(20)14-5-8-17-18(11-14)22-12-21-17/h3-11,19H,2,12H2,1H3/b10-9+InChIKey
IQFITFFSKFICQB-MDZDMXLPSA-NSynonyms
(2E)1(13benzodioxol5yl)3((4ethylphenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(4ethylanilino)prop2en1one
CCC1=CC=C(C=C1)NC=CC(=O)C2=CC3=C(C=C2)OCO3
CCc1ccc(cc1)NC=CC(=O)c1ccc2c(c1)OCO2
InChI=1SC18H17NO3c12133615(7413)1910916(20)14581718(1114)22122117h31119H212H21H3b109+
MFCD18174744
ZINC000044842368
ZINC44842368
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