Vitas-M small molecule compound

(2E)-3-(4-ethoxy-3-nitrophenyl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile

Catalog ID
STK115343
SMILES CCOc1ccc(cc1[N+](=O)[O-])/C=C(/C(=O)N1CCOCC1)\C#N

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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 C16H17N3O5 MW 331.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O5/c1-2-24-15-4-3-12(10-14(15)19(21)22)9-13(11-17)16(20)18-5-7-23-8-6-18/h3-4,9-10H,2,5-8H2,1H3/b13-9+
InChIKey
HNXLGVHLXPRUEA-UKTHLTGXSA-N
Synonyms

(2E)3(4ETHOXY3NITROPHENYL)2(MORPHOLIN4YLCARBONYL)PROP2ENENITRILE
(E)3(4ETHOXY3NITROPHENYL)2(MORPHOLINE4CARBONYL)PROP2ENENITRILE
CCOC1=C(C=C(C=C1)C=C(C#N)C(=O)N2CCOCC2)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C=C(C(=O)N1CCOCC1)C#N
InChI=1SC16H17N3O5c1224154312(1014(15)19(21)22)913(1117)16(20)1857238618h34910H258H21H3b139+
MFCD08680108
ZINC000023157210
ZINC23157210

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Available files

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