Vitas-M small molecule compound
2-(4-nitrophenyl)-2-oxoethyl 4-(phenylethynyl)benzoate
Catalog ID
STK138109
SMILES O=C(c1ccc(cc1)C#Cc1ccccc1)OCC(=O)c1ccc(cc1)[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 C23H15NO5 MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15NO5/c25-22(19-12-14-21(15-13-19)24(27)28)16-29-23(26)20-10-8-18(9-11-20)7-6-17-4-2-1-3-5-17/h1-5,8-15H,16H2InChIKey
BFDOVYUHSUNWPK-UHFFFAOYSA-NSynonyms
(2(4NITROPHENYL)2OXOETHYL)4(2PHENYLETHYNYL)BENZOATE
2(4NITROPHENYL)2OXOETHYL4(PHENYLETHYNYL)BENZOATE
C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC23H15NO5c2522(19121421(151319)24(27)28)162923(26)2010818(91120)76174213517h15815H16H2
MFCD02210826
O=C(c1ccc(cc1)C#Cc1ccccc1)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000002816200
ZINC02816200
ZINC2816200
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