Vitas-M small molecule compound
(2Z,6E)-2,6-bis(4-nitrobenzylidene)cyclohexanone
Catalog ID
STL168524
SMILES O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/CCC/C/1=C/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 C20H16N2O5 MW 364.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5/c23-20-16(12-14-4-8-18(9-5-14)21(24)25)2-1-3-17(20)13-15-6-10-19(11-7-15)22(26)27/h4-13H,1-3H2/b16-12-,17-13+InChIKey
IBFHBKDCSZGUSP-RFTYBOQRSA-NSynonyms
(2E6Z)26bis((4nitrophenyl)methylidene)cyclohexan1one
(2Z6E)26bis(4nitrobenzylidene)cyclohexanone
26BIS((4NITROPHENYL)METHYLENE)CYCLOHEXAN1ONE
C1CC(=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)C(=CC3=CC=C(C=C3)(N+)(=O)(O))C1
InChI=1SC20H16N2O5c232016(12144818(9514)21(24)25)21317(20)131561019(11715)22(26)27h413H13H2b16121713+
MFCD00358703
O=C1C(=Cc2ccc(cc2)(N+)(=O)(O))CCCC1=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000017862477
ZINC17862477
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