Vitas-M small molecule compound
(2E)-3-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-1-(pyrrolidin-1-yl)prop-2-en-1-one
Catalog ID
STK692854
SMILES COc1c(/C=C/C(=O)N2CCCC2)cc2c(c1OC)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 C16H19NO5 MW 305.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO5/c1-19-14-11(5-6-13(18)17-7-3-4-8-17)9-12-15(16(14)20-2)22-10-21-12/h5-6,9H,3-4,7-8,10H2,1-2H3/b6-5+InChIKey
KEZQPEQTIXBYKJ-AATRIKPKSA-NSynonyms
(2E)3(67dimethoxy13benzodioxol5yl)1(pyrrolidin1yl)prop2en1one
(E)3(67dimethoxy13benzodioxol5yl)1pyrrolidin1ylprop2en1one
COC1=C(C2=C(C=C1C=CC(=O)N3CCCC3)OCO2)OC
COc1c(C=CC(=O)N2CCCC2)cc2c(c1OC)OCO2
InChI=1SC16H19NO5c1191411(5613(18)17734817)91215(16(14)202)22102112h569H347810H212H3b65+
MFCD10038877
ZINC000014638341
ZINC14638341
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