Chem
J-GLOBAL ID：201507015778652159
Nikkaji number：J3.402.126K
2,2′-(1,4-Phenylene)bis[3-[4-[2-(1-carboxypropane-2-ylideneaminooxy)ethoxy]phenyl]acrylonitrile]
2,2′-(1,4-フェニレン)ビス[3-[4-[2-(1-カルボキシプロパン-2-イリデンアミノオキシ)エトキシ]フェニル]アクリロニトリル]
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
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
Molecular formula： C36H34N4O8
Molecular formula furigana： C36-H34-N4-O8
Molecular weight： 650.688
InChI：
InChI=1S/C36H34N4O8/c1-25(19-35(41)42)39-47-17-15-45-33-11-3-27(4-12-33)21-31(23-37)29-7-9-30(10-8-29)32(24-38)22-28-5-13-34(14-6-28)46-16-18-48-40-26(2)20-36(43)44/h3-14,21-22H,15-20H2,1-2H3,(H,41,42)(H,43,44)
InChI key：
NEZRKLQVDOIGSK-UHFFFAOYSA-N
SMILES：
CC(=NOCCOc1ccc(C=C(C#N)c2ccc(cc2)C(=Cc2ccc(OCCON=C(C)CC(=O)O)cc2)C#N)cc1)CC(=O)O
Systematic name (3)：
- 2,2′-(1,4-フェニレン)ビス[3-[4-[2-(1-カルボキシプロパン-2-イリデンアミノオキシ)エトキシ]フェニル]アクリロニトリル]
- 3-[(2-{4-[2-(4-{2-[4-(2-{[(1-カルボキシプロパン-2-イリデン)アミノ]オキシ}エトキシ)フェニル]-1-シアノエタ-1-エン-1-イル}フェニル)-2-シアノエタ-1-エン-1-イル]フェノキシ}エトキシ)イミノ]ブタン酸
- 3-[(2-{4-[2-(4-{2-[4-(2-{[(1-carboxypropan-2-ylidene)amino]oxy}ethoxy)phenyl]-1-cyanoeth-1-en-1-yl}phenyl)-2-cyanoeth-1-en-1-yl]phenoxy}ethoxy)imino]butanoic acid
- 2,2′-(1,4-Phenylene)bis[3-[4-[2-(1-carboxypropane-2-ylideneaminooxy)ethoxy]phenyl]acrylonitrile]
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