Vitas-M small molecule compound
2-[4-(benzyloxy)phenyl]-2-oxoethyl 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate
Catalog ID
STK388964
SMILES O=C(c1ccc(cc1)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)OCC(=O)c1ccc(cc1)OCc1ccccc1
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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 C29H20F3NO7 MW 551.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20F3NO7/c30-29(31,32)22-10-15-27(25(16-22)33(36)37)40-24-13-8-21(9-14-24)28(35)39-18-26(34)20-6-11-23(12-7-20)38-17-19-4-2-1-3-5-19/h1-16H,17-18H2InChIKey
BSARFWGXIBIUPM-UHFFFAOYSA-NSynonyms
355426-29-8(2OXO2(4PHENYLMETHOXYPHENYL)ETHYL)4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)BENZOATE
2(4(benzyloxy)phenyl)2oxoethyl4(2nitro4(trifluoromethyl)phenoxy)benzoate
355426298
C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
InChI=1SC29H20F3NO7c3029(3132)22101527(25(1622)33(36)37)402413821(91424)28(35)391826(34)2061123(12720)3817194213519h116H1718H2
MFCD02188940
O=C(c1ccc(cc1)Oc1ccc(cc1(N+)(=O)(O))C(F)(F)F)OCC(=O)c1ccc(cc1)OCc1ccccc1
ZINC000002772680
ZINC02772680
ZINC2772680
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