Vitas-M small molecule compound

(2E)-1-(pyrrolidin-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one

Catalog ID
STK093952
SMILES COc1cc(/C=C/C(=O)N2CCCC2)cc(c1OC)OC

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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 C16H21NO4 MW 291.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO4/c1-19-13-10-12(11-14(20-2)16(13)21-3)6-7-15(18)17-8-4-5-9-17/h6-7,10-11H,4-5,8-9H2,1-3H3/b7-6+
InChIKey
TYFKYDTUEMTUNY-VOTSOKGWSA-N
Synonyms
886989-88-4
(2E)1(PYRROLIDIN1YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(2E)1PYRROLIDINYL3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(1PYRROLIDINYL)3(345TRIMETHOXYPHENYL)2PROPEN1ONE
(E)1PYRROLIDIN1YL3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1PYRROLIDINO3(345TRIMETHOXYPHENYL)PROP2EN1ONE
1(3(345TRIMETHOXYPHENYL)ACRYLOYL)PYRROLIDINE
1(345TRIMETHOXYCINNAMOYL)PYRROLIDINE
1(345TRIMETOSSICINNAMOIL)PIRROLIDINA
1PYRROLIDIN1YL3(345TRIMETHOXYPHENYL)PROP2EN1ONE
2PROPEN1ONE1(1PYRROLIDINYL)3(345TRIMETHOXYPHENYL)(2E)
886989884
COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCCC2
COc1cc(C=CC(=O)N2CCCC2)cc(c1OC)OC
InChI=1SC16H21NO4c119131012(1114(202)16(13)213)6715(18)17845917h671011H4589H213H3b76+
MFCD01687666
PYRROLIDINE1(345TRIMETHOXYCINNAMOYL)
STK093952
ZINC000000318977
ZINC00318977
ZINC318977

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.