Vitas-M small molecule compound

1-(2-hydroxyethyl)-2,6-bis(4-nitrophenyl)-4-phenylpyridinium

Catalog ID
STK729667
SMILES OCC[n+]1c(cc(cc1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)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 C25H20N3O5 MW 442.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N3O5/c29-15-14-26-24(19-6-10-22(11-7-19)27(30)31)16-21(18-4-2-1-3-5-18)17-25(26)20-8-12-23(13-9-20)28(32)33/h1-13,16-17,29H,14-15H2/q+1
InChIKey
FCUPMWYCBPFBLE-UHFFFAOYSA-N
Synonyms

1(2hydroxyethyl)26bis(4nitrophenyl)4phenylpyridin1iumchloride
1(2hydroxyethyl)26bis(4nitrophenyl)4phenylpyridinium
2(26BIS(4NITROPHENYL)4PHENYLPYRIDIN1IUM1YL)ETHANOL
C1=CC=C(C=C1)C2=CC(=(N+)(C(=C2)C3=CC=C(C=C3)(N+)(=O)(O))CCO)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC25H20N3O5c2915142624(1961022(11719)27(30)31)1621(184213518)1725(26)2081223(13920)28(32)33h113161729H1415H2q+1
MFCD02043006
OCC(n+)1c(cc(cc1c1ccc(cc1)(N+)(=O)(O))c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
OCC(n+)1c(cc(cc1c1ccc(cc1)(N+)(=O)(O))c1ccccc1)c1ccc(cc1)(N+)(=O)(O)(Cl)
ZINC000001792010
ZINC01792010
ZINC1792010

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Available files

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