Vitas-M small molecule compound

(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)-N-(2-nitrophenyl)prop-2-enamide

Catalog ID
STK949571
SMILES N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1ccccc1[N+](=O)[O-]

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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 C17H13N3O5 MW 339.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O5/c1-25-16-9-11(6-7-15(16)21)8-12(10-18)17(22)19-13-4-2-3-5-14(13)20(23)24/h2-9,21H,1H3,(H,19,22)/b12-8+
InChIKey
ZCFRLGNQZFKVCU-XYOKQWHBSA-N
Synonyms
327064-02-8
(2E)2cyano3(4hydroxy3methoxyphenyl)N(2nitrophenyl)prop2enamide
(E)2CYANO3(4HYDROXY3METHOXYPHENYL)N(2NITROPHENYL)PROP2ENAMIDE
327064028
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2(N+)(=O)(O))O
InChI=1SC17H13N3O5c12516911(6715(16)21)812(1018)17(22)1913423514(13)20(23)24h2921H1H3(H1922)b128+
MFCD02353815
N#CC(=Cc1ccc(c(c1)OC)O)C(=O)Nc1ccccc1(N+)(=O)(O)
ZINC000004175580
ZINC04175580
ZINC4175580

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Available files

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