Vitas-M small molecule compound

2-[(5-nitroquinolin-8-yl)amino]butan-1-ol

Catalog ID
STK028588
SMILES CCC(Nc1ccc(c2c1nccc2)[N+](=O)[O-])CO

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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 C13H15N3O3 MW 261.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O3/c1-2-9(8-17)15-11-5-6-12(16(18)19)10-4-3-7-14-13(10)11/h3-7,9,15,17H,2,8H2,1H3
InChIKey
YKCYNBVEMRCWRC-UHFFFAOYSA-N
Synonyms
346704-08-3
2((5NITRO8QUINOLYL)AMINO)BUTAN1OL
2((5NITROQUINOLIN8YL)AMINO)BUTAN1OL
2(5NITROQUINOLIN8YLAMINO)BUTAN1OL
346704083
CCC(CO)NC1=C2C(=C(C=C1)(N+)(=O)(O))C=CC=N2
CCC(Nc1ccc(c2c1nccc2)(N+)(=O)(O))CO
InChI=1SC13H15N3O3c129(817)15115612(16(18)19)104371413(10)11h3791517H28H21H3
MFCD01446102
STK028588
ZINC000004046651
ZINC000004046652

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.