Vitas-M small molecule compound
4-{(Z)-[2-(3-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}benzonitrile
Catalog ID
STK117795
SMILES N#Cc1ccc(cc1)/C=C/1\N=C(OC1=O)c1cccc(c1)[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 C17H9N3O4 MW 319.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9N3O4/c18-10-12-6-4-11(5-7-12)8-15-17(21)24-16(19-15)13-2-1-3-14(9-13)20(22)23/h1-9H/b15-8-InChIKey
DBOKHAGTOQSMPR-NVNXTCNLSA-NSynonyms
4((Z)(2(3NITROPHENYL)5OXO13OXAZOL4(5H)YLIDENE)METHYL)BENZONITRILE
4((Z)(2(3NITROPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)BENZONITRILE
C1=CC(=CC(=C1)(N+)(=O)(O))C2=NC(=CC3=CC=C(C=C3)C#N)C(=O)O2
InChI=1SC17H9N3O4c1810126411(5712)81517(21)2416(1915)1321314(913)20(22)23h19Hb158
MFCD04507461
N#Cc1ccc(cc1)C=C1N=C(OC1=O)c1cccc(c1)(N+)(=O)(O)
ZINC000004691079
ZINC04691079
ZINC4691079
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