Vitas-M small molecule compound

2-(1-hexylpyridin-4(1H)-ylidene)-1H-indene-1,3(2H)-dione

Catalog ID
STK870727
SMILES CCCCCCn1cc/c(=C/2\C(=O)c3c(C2=O)cccc3)/cc1

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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 C20H21NO2 MW 307.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO2/c1-2-3-4-7-12-21-13-10-15(11-14-21)18-19(22)16-8-5-6-9-17(16)20(18)23/h5-6,8-11,13-14H,2-4,7,12H2,1H3
InChIKey
DHYINZKOECIVEY-UHFFFAOYSA-N
Synonyms
67592-41-0
2(1HEXYL1HPYRIDIN4YLIDENE)INDAN13DIONE
2(1HEXYL4HYDROPYRIDYLIDENE)CYCLOPENTA(12A)BENZENE13DIONE
2(1HEXYL4PYRIDINYLIDENE)INDENE13DIONE
2(1HEXYL4PYRIDYLIDENE)INDANE13QUINONE
2(1hexylpyridin4(1H)ylidene)1Hindene13(2H)dione
2(1HEXYLPYRIDIN4YLIDENE)INDENE13DIONE
67592410
CCCCCCN1C=CC(=C2C(=O)C3=CC=CC=C3C2=O)C=C1
CCCCCCn1ccc(=C2C(=O)c3c(C2=O)cccc3)cc1
InChI=1SC20H21NO2c123471221131015(111421)1819(22)16856917(16)20(18)23h568111314H24712H21H3
MFCD00604672
ZINC000002268019
ZINC2268019

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Available files

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