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3,3-dimethyl-11-[5-(3-nitrophenyl)furan-2-yl]-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK131404
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1cccc(c1)[N+](=O)[O-])N(c1c(N2)cccc1)C(=O)C(F)(F)F

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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 C27H22F3N3O5 MW 525.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22F3N3O5/c1-26(2)13-18-23(20(34)14-26)24(22-11-10-21(38-22)15-6-5-7-16(12-15)33(36)37)32(25(35)27(28,29)30)19-9-4-3-8-17(19)31-18/h3-12,24,31H,13-14H2,1-2H3
InChIKey
QQHYAQUYNOOSLO-UHFFFAOYSA-N
Synonyms
330644-45-6
330644456
33DIMETHYL11(5(3NITROPHENYL)(2FURYL))10(222TRIFLUOROACETYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
33dimethyl11(5(3nitrophenyl)furan2yl)10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl11(5(3nitrophenyl)furan2yl)10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(5(3nitrophenyl)furan2yl)5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C(F)(F)F)C4=CC=C(O4)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C1)C
InChI=1SC27H22F3N3O5c126(2)131823(20(34)1426)24(22111021(3822)1565716(1215)33(36)37)32(25(35)27(2829)30)19943817(19)3118h3122431H1314H212H3
MFCD01921844
O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1cccc(c1)(N+)(=O)(O))N(c1c(N2)cccc1)C(=O)C(F)(F)F
ZINC000001306460
ZINC000017951225

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Available files

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