Vitas-M small molecule compound

(2E,6E)-2-(furan-2-ylmethylidene)-6-(3-nitrobenzylidene)cyclohexanone

Catalog ID
STL335675
SMILES O=C1/C(=C/c2cccc(c2)[N+](=O)[O-])/CCC/C/1=C\c1ccco1

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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 C18H15NO4 MW 309.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO4/c20-18-14(10-13-4-1-7-16(11-13)19(21)22)5-2-6-15(18)12-17-8-3-9-23-17/h1,3-4,7-12H,2,5-6H2/b14-10+,15-12+
InChIKey
UODZVFWKPDUPIB-VDQVFBMKSA-N
Synonyms
878050-98-7
(2E6E)2(furan2ylmethylene)6(3nitrobenzylidene)cyclohexanone
(2E6E)2(FURAN2YLMETHYLIDENE)6((3NITROPHENYL)METHYLIDENE)CYCLOHEXAN1ONE
(2E6E)2(furan2ylmethylidene)6(3nitrobenzylidene)cyclohexanone
878050987
C1CC(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)C(=CC3=CC=CO3)C1
CYCLOHEXANONE2(2FURANYLMETHYLENE)6((3NITROPHENYL)METHYLENE)(2E6E)
InChI=1SC18H15NO4c201814(101341716(1113)19(21)22)52615(18)12178392317h134712H256H2b1410+1512+
MFCD03303252
O=C1C(=Cc2cccc(c2)(N+)(=O)(O))CCCC1=Cc1ccco1
ZINC000004954807
ZINC04954807
ZINC4954807

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Available files

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