Vitas-M small molecule compound
4-(quinoxalin-2-yl)phenyl 3-(2-chloro-6-nitrophenoxy)benzoate
Catalog ID
STK536559
SMILES O=C(c1cccc(c1)Oc1c(Cl)cccc1[N+](=O)[O-])Oc1ccc(cc1)c1cnc2c(n1)cccc2
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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 C27H16ClN3O5 MW 497.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H16ClN3O5/c28-21-7-4-10-25(31(33)34)26(21)35-20-6-3-5-18(15-20)27(32)36-19-13-11-17(12-14-19)24-16-29-22-8-1-2-9-23(22)30-24/h1-16HInChIKey
QLEWQUIBGFFCMW-UHFFFAOYSA-NSynonyms
(4QUINOXALIN2YLPHENYL)3(2CHLORO6NITROPHENOXY)BENZOATE
4(quinoxalin2yl)phenyl3(2chloro6nitrophenoxy)benzoate
C1=CC=C2C(=C1)N=CC(=N2)C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)OC5=C(C=CC=C5Cl)(N+)(=O)(O)
InChI=1SC27H16ClN3O5c2821741025(31(33)34)26(21)352063518(1520)27(32)3619131117(121419)24162922812923(22)3024h116H
MFCD02989662
O=C(c1cccc(c1)Oc1c(Cl)cccc1(N+)(=O)(O))Oc1ccc(cc1)c1cnc2c(n1)cccc2
ZINC000001807622
ZINC01807622
ZINC1807622
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