Vitas-M small molecule compound

(2E)-3-(3,4-dimethoxyphenyl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile

Catalog ID
STK497488
SMILES N#C/C(=C\c1ccc(c(c1)OC)OC)/C(=O)N1CCOCC1

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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 C16H18N2O4 MW 302.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4/c1-20-14-4-3-12(10-15(14)21-2)9-13(11-17)16(19)18-5-7-22-8-6-18/h3-4,9-10H,5-8H2,1-2H3/b13-9+
InChIKey
RQXWIMADWQNBAJ-UKTHLTGXSA-N
Synonyms

(2E)3(34dimethoxyphenyl)2(morpholin4ylcarbonyl)prop2enenitrile
(E)3(34DIMETHOXYPHENYL)2(MORPHOLINE4CARBONYL)PROP2ENENITRILE
COC1=C(C=C(C=C1)C=C(C#N)C(=O)N2CCOCC2)OC
InChI=1SC16H18N2O4c120144312(1015(14)212)913(1117)16(19)1857228618h34910H58H212H3b139+
MFCD00121397
N#CC(=Cc1ccc(c(c1)OC)OC)C(=O)N1CCOCC1
ZINC000000432600
ZINC00432600
ZINC432600

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Available files

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