Chem
J-GLOBAL ID：200907092827920470   Nikkaji number：J2.589.162G

(3R,4R)-N,N′-Bis(3,5-dimethylbenzyl)-N,N′-dihydroxy-1,6-diphenyl-1,5-hexadiyne-3,4-diamine

(3R,4R)-N,N′-ビス(3,5-ジメチルベンジル)-N,N′-ジヒドロキシ-1,6-ジフェニル-1,5-ヘキサジイン-3,4-ジアミン
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： C36H36N2O2
Molecular formula furigana： C36-H36-N2-O2
Molecular weight： 528.696
InChI： InChI=1S/C36H36N2O2/c1-27-19-28(2)22-33(21-27)25-37(39)35(17-15-31-11-7-5-8-12-31)36(18-16-32-13-9-6-10-14-32)38(40)26-34-23-29(3)20-30(4)24-34/h5-14,19-24,35-36,39-40H,25-26H2,1-4H3/t35-,36-/m1/s1
InChI key： IDOIVOUNVXNYMF-LQFQNGICSA-N
SMILES： Cc1cc(C)cc(CN(O)[C@H](C#Cc2ccccc2)[C@@H](C#Cc2ccccc2)N(O)Cc2cc(C)cc(C)c2)c1
Systematic name  (3)：
  • (3R,4R)-N,N′-ビス(3,5-ジメチルベンジル)-N,N′-ジヒドロキシ-1,6-ジフェニル-1,5-ヘキサジイン-3,4-ジアミン
  • N-[(3,5-ジメチルフェニル)メチル]-N-[(3R,4R)-4-{[(3,5-ジメチルフェニル)メチル](ヒドロキシ)アミノ}-1,6-ジフェニルヘキサ-1,5-ジイン-3-イル]ヒドロキシルアミン
  • N-[(3,5-dimethylphenyl)methyl]-N-[(3R,4R)-4-{[(3,5-dimethylphenyl)methyl](hydroxy)amino}-1,6-diphenylhexa-1,5-diyn-3-yl]hydroxylamine
Other name (1)：
  • (3R,4R)-N,N′-Bis(3,5-dimethylbenzyl)-N,N′-dihydroxy-1,6-diphenyl-1,5-hexadiyne-3,4-diamine
Thsaurus map：
Thesaurus Map

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