Vitas-M small molecule compound

7-chloro-2,3-dimethyl-6-nitro-1-(4-nitrophenyl)quinolin-4(1H)-one

Catalog ID
STL290446
SMILES [O-][N+](=O)c1ccc(cc1)n1c(C)c(C)c(=O)c2c1cc(Cl)c(c2)[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 C17H12ClN3O5 MW 373.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O5/c1-9-10(2)19(11-3-5-12(6-4-11)20(23)24)15-8-14(18)16(21(25)26)7-13(15)17(9)22/h3-8H,1-2H3
InChIKey
UPECSEKJXHQFND-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)n1c(C)c(C)c(=O)c2c1cc(Cl)c(c2)(N+)(=O)(O)
7chloro23dimethyl6nitro1(4nitrophenyl)quinolin4(1H)one
7chloro23dimethyl6nitro1(4nitrophenyl)quinolin4one
CC1=C(N(C2=CC(=C(C=C2C1=O)(N+)(=O)(O))Cl)C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC17H12ClN3O5c1910(2)19(113512(6411)20(23)24)15814(18)16(21(25)26)713(15)17(9)22h38H12H3
MFCD19703203
ZINC000072434017
ZINC72434017

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Available files

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