Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(4-ethoxyphenyl)prop-2-en-1-one
Catalog ID
STL382250
SMILES CCOc1ccc(cc1)C(=O)/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 C18H16O4 MW 296.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O4/c1-2-20-15-7-5-14(6-8-15)16(19)9-3-13-4-10-17-18(11-13)22-12-21-17/h3-11H,2,12H2,1H3/b9-3+InChIKey
RZDQLZHFYWPQGC-YCRREMRBSA-NSynonyms
1689543-96-1(2E)3(13benzodioxol5yl)1(4ethoxyphenyl)prop2en1one
(E)3(13BENZODIOXOL5YL)1(4ETHOXYPHENYL)PROP2EN1ONE
1689543961
CCOC1=CC=C(C=C1)C(=O)C=CC2=CC3=C(C=C2)OCO3
CCOc1ccc(cc1)C(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC18H16O4c1220157514(6815)16(19)93134101718(1113)22122117h311H212H21H3b93+
MFCD01901541
ZINC000005073029
ZINC05073029
ZINC5073029
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