Vitas-M small molecule compound
4-methyl-6-[(4-nitrobenzyl)oxy]-3-phenyl-2H-chromen-2-one
Catalog ID
STL033622
SMILES O=c1oc2ccc(cc2c(c1c1ccccc1)C)OCc1ccc(cc1)[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 C23H17NO5 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17NO5/c1-15-20-13-19(28-14-16-7-9-18(10-8-16)24(26)27)11-12-21(20)29-23(25)22(15)17-5-3-2-4-6-17/h2-13H,14H2,1H3InChIKey
UIQHVFIAFNTCIK-UHFFFAOYSA-NSynonyms
4methyl6((4nitrobenzyl)oxy)3phenyl2Hchromen2one
4METHYL6((4NITROPHENYL)METHOXY)3PHENYLCHROMEN2ONE
CC1=C(C(=O)OC2=C1C=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
InChI=1SC23H17NO5c115201319(2814167918(10816)24(26)27)111221(20)2923(25)22(15)175324617h213H14H21H3
MFCD05940300
O=c1oc2ccc(cc2c(c1c1ccccc1)C)OCc1ccc(cc1)(N+)(=O)(O)
ZINC000004340584
ZINC04340584
ZINC4340584
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