Vitas-M small molecule compound
4-(quinoxalin-2-yl)phenyl 3-methyl-4-nitrobenzoate
Catalog ID
STL329640
SMILES O=C(c1ccc(c(c1)C)[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 C22H15N3O4 MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O4/c1-14-12-16(8-11-21(14)25(27)28)22(26)29-17-9-6-15(7-10-17)20-13-23-18-4-2-3-5-19(18)24-20/h2-13H,1H3InChIKey
QMVHKPVFGVIRIQ-UHFFFAOYSA-NSynonyms
(4QUINOXALIN2YLPHENYL)3METHYL4NITROBENZOATE
4(2QUINOXALINYL)PHENYL4NITRO3METHYLBENZOATE
4(quinoxalin2yl)phenyl3methyl4nitrobenzoate
CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C3=NC4=CC=CC=C4N=C3)(N+)(=O)(O)
InChI=1SC22H15N3O4c1141216(81121(14)25(27)28)22(26)29179615(71017)20132318423519(18)2420h213H1H3
MFCD01360273
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Oc1ccc(cc1)c1cnc2c(n1)cccc2
ZINC000000991334
ZINC00991334
ZINC991334
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