Vitas-M small molecule compound

2-{[5-(morpholin-4-yl)-2-nitrophenyl]amino}butan-1-ol

Catalog ID
STK005485
SMILES CCC(Nc1cc(ccc1[N+](=O)[O-])N1CCOCC1)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 C14H21N3O4 MW 295.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3O4/c1-2-11(10-18)15-13-9-12(3-4-14(13)17(19)20)16-5-7-21-8-6-16/h3-4,9,11,15,18H,2,5-8,10H2,1H3
InChIKey
QRJVLGKRJMNHPD-UHFFFAOYSA-N
Synonyms

2((5(MORPHOLIN4YL)2NITROPHENYL)AMINO)BUTAN1OL
2(5MORPHOLIN4YL2NITROANILINO)BUTAN1OL
CCC(CO)NC1=C(C=CC(=C1)N2CCOCC2)(N+)(=O)(O)
CCC(Nc1cc(ccc1(N+)(=O)(O))N1CCOCC1)CO
InChI=1SC14H21N3O4c1211(1018)1513912(3414(13)17(19)20)1657218616h349111518H25810H21H3
MFCD01580181
STK005485
ZINC000004081294
ZINC000004081299

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Available files

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