Vitas-M small molecule compound
9,9-dimethyl-12-(4-nitrophenyl)-8,9,10,12-tetrahydro-11H-benzo[a]xanthen-11-one
Catalog ID
STL506553
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)[N+](=O)[O-])c1c(O2)ccc2c1cccc2
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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 C25H21NO4 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO4/c1-25(2)13-19(27)24-21(14-25)30-20-12-9-15-5-3-4-6-18(15)23(20)22(24)16-7-10-17(11-8-16)26(28)29/h3-12,22H,13-14H2,1-2H3InChIKey
AFAUJOVZUDGAKM-UHFFFAOYSA-NSynonyms
12(4NITROPHENYL)99DIMETHYL89DIHYDRO12HBENZO(A)XANTHENE11(10H)ONE
42642778
99dimethyl12(4nitrophenyl)1012dihydro8~(H)benzo(a)xanthen11one
99dimethyl12(4nitrophenyl)891012tetrahydro11Hbenzo(a)xanthen11one
InChI=1SC25H21NO4c125(2)1319(27)2421(1425)302012915534618(15)23(20)22(24)1671017(11816)26(28)29h31222H1314H212H3
MFCD31614475
ZINC000143315750
ZINC000143315974
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