Vitas-M small molecule compound

1-(4-nitrobenzyl)-3-(quinolin-2-yl)quinolinium

Catalog ID
STK379496
SMILES [O-][N+](=O)c1ccc(cc1)C[n+]1cc(cc2c1cccc2)c1ccc2c(n1)cccc2

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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 C25H18N3O2 MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N3O2/c29-28(30)22-12-9-18(10-13-22)16-27-17-21(15-20-6-2-4-8-25(20)27)24-14-11-19-5-1-3-7-23(19)26-24/h1-15,17H,16H2/q+1
InChIKey
VJRACKUGIMQVSW-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)C(n+)1cc(cc2c1cccc2)c1ccc2c(n1)cccc2
1((4NITROPHENYL)METHYL)3QUINOLIN2YLQUINOLIN1IUM
1(4nitrobenzyl)3(quinolin2yl)quinolinium
C1=CC=C2C(=C1)C=CC(=N2)C3=CC4=CC=CC=C4(N+)(=C3)CC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC25H18N3O2c2928(30)2212918(101322)16271721(1520624825(20)27)24141119513723(19)2624h11517H16H2q+1
MFCD01824230
ZINC000004062567
ZINC04062567
ZINC4062567

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Available files

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