Vitas-M small molecule compound
6-[(E)-2-(3-hydroxyphenyl)ethenyl]-4-(methoxymethyl)-5-nitro-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL370101
SMILES COCc1c([N+](=O)[O-])c(/C=C/c2cccc(c2)O)[nH]c(=O)c1C#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 C16H13N3O5 MW 327.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5/c1-24-9-13-12(8-17)16(21)18-14(15(13)19(22)23)6-5-10-3-2-4-11(20)7-10/h2-7,20H,9H2,1H3,(H,18,21)/b6-5+InChIKey
PHISQIUMCLXLSD-AATRIKPKSA-NSynonyms
6((E)2(3hydroxyphenyl)ethenyl)4(methoxymethyl)5nitro2oxo12dihydropyridine3carbonitrile
6((E)2(3hydroxyphenyl)ethenyl)4(methoxymethyl)5nitro2oxo1Hpyridine3carbonitrile
COCC1=C(C(=O)NC(=C1(N+)(=O)(O))C=CC2=CC(=CC=C2)O)C#N
COCc1c((N+)(=O)(O))c(C=Cc2cccc(c2)O)(nH)c(=O)c1C#N
InChI=1SC16H13N3O5c12491312(817)16(21)1814(15(13)19(22)23)651032411(20)710h2720H9H21H3(H1821)b65+
MFCD28950883
ZINC000096252962
ZINC96252962
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