Chem
J-GLOBAL ID:201707006405477816
Nikkaji number:J3.583.215G
α,α′,α′′-(Nitrilotrisethylene)tris(3,5-di(trifluoromethyl)benzaldehyde)
α,α′,α′′-(ニトリロトリスエチレン)トリス(3,5-ジ(トリフルオロメチル)ベンズアルデヒド)
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C33 H21 F18 NO3
Molecular formula furigana:
C33-H21-F18-N-O3
Molecular weight:
821.506
InChI:
InChI=1S/C33H21F18NO3/c34-28(35,36)19-7-16(8-20(13-19)29(37,38)39)25(53)1-4-52(5-2-26(54)17-9-21(30(40,41)42)14-22(10-17)31(43,44)45)6-3-27(55)18-11-23(32(46,47)48)15-24(12-18)33(49,50)51/h7-15H,1-6H2
InChI key:
OHLMDEZGKRTQOV-UHFFFAOYSA-N
SMILES:
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)CCN(CCC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)CCC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
Systematic name (3):
α,α′,α′′-(ニトリロトリスエチレン)トリス(3,5-ジ(トリフルオロメチル)ベンズアルデヒド)
1-[3,5-ビス(トリフルオロメチル)フェニル]-3-[ビス({3-[3,5-ビス(トリフルオロメチル)フェニル]-3-オキソプロピル})アミノ]プロパン-1-オン
1-[3,5-bis(trifluoromethyl)phenyl]-3-[bis({3-[3,5-bis(trifluoromethyl)phenyl]-3-oxopropyl})amino]propan-1-one
Other name (1):
α,α′,α′′-(Nitrilotrisethylene)tris(3,5-di(trifluoromethyl)benzaldehyde)
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