Vitas-M small molecule compound

ethyl 4-[(5,7-dinitroquinolin-8-yl)amino]benzoate

Catalog ID
STL336595
SMILES CCOC(=O)c1ccc(cc1)Nc1c(cc(c2c1nccc2)[N+](=O)[O-])[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 C18H14N4O6 MW 382.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O6/c1-2-28-18(23)11-5-7-12(8-6-11)20-17-15(22(26)27)10-14(21(24)25)13-4-3-9-19-16(13)17/h3-10,20H,2H2,1H3
InChIKey
KHMFIESLBMIBDL-UHFFFAOYSA-N
Synonyms
314036-00-5
314036005
CCOC(=O)C1=CC=C(C=C1)NC2=C(C=C(C3=C2N=CC=C3)(N+)(=O)(O))(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)Nc1c(cc(c2c1nccc2)(N+)(=O)(O))(N+)(=O)(O)
ethyl4((57dinitroquinolin8yl)amino)benzoate
InChI=1SC18H14N4O6c122818(23)115712(8611)201715(22(26)27)1014(21(24)25)134391916(13)17h31020H2H21H3
MFCD01130630
ZINC000004420695
ZINC04420695
ZINC4420695

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Available files

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