Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-[(2-ethylphenyl)amino]prop-2-en-1-one
Catalog ID
STK902216
SMILES CCc1ccccc1N/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/c1-2-13-5-3-4-6-15(13)19-10-9-16(20)14-7-8-17-18(11-14)22-12-21-17/h3-11,19H,2,12H2,1H3/b10-9+InChIKey
JDQYNZBIIWFMNL-MDZDMXLPSA-NSynonyms
(2E)1(13benzodioxol5yl)3((2ethylphenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(2ethylanilino)prop2en1one
CCC1=CC=CC=C1NC=CC(=O)C2=CC3=C(C=C2)OCO3
CCc1ccccc1NC=CC(=O)c1ccc2c(c1)OCO2
InChI=1SC18H17NO3c1213534615(13)1910916(20)14781718(1114)22122117h31119H212H21H3b109+
MFCD18174742
ZINC000044842358
ZINC44842358
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