(3E)-3-[[4-[(Z)-3-[4-[(2-Methylbenzimidazol-1-Yl)Methyl]Piperidin-1-Yl]-3-Oxo-1-Phenylprop-1-Enyl]Phenyl]Hydrazinylidene]-6-Oxocyclohexa-1,4-Diene-1-Carboxylic Acid
[CAS# 188913-58-8]

Identification

• Name: (3E)-3-[[4-[(Z)-3-[4-[(2-Methylbenzimidazol-1-Yl)Methyl]Piperidin-1-Yl]-3-Oxo-1-Phenylprop-1-Enyl]Phenyl]Hydrazinylidene]-6-Oxocyclohexa-1,4-Diene-1-Carboxylic Acid
• Synonyms: (3E)-3-[[4-[(Z)-3-[4-[(2-Methylbenzimidazol-1-Yl)Methyl]-1-Piperidyl]-3-Oxo-1-Phenyl-Prop-1-Enyl]Phenyl]Hydrazono]-6-Oxo-Cyclohexa-1,4-Diene-1-Carboxylic Acid; (3E)-3-[[4-[(Z)-3-[4-[(2-Methyl-1-Benzimidazolyl)Methyl]-1-Piperidinyl]-3-Oxo-1-Phenylprop-1-Enyl]Phenyl]Hydrazono]-6-Oxo-1-Cyclohexa-1,4-Dienecarboxylic Acid; (3E)-6-Keto-3-[[4-[(Z)-3-Keto-3-[4-[(2-Methylbenzimidazol-1-Yl)Methyl]-1-Piperidyl]-1-Phenyl-Prop-1-Enyl]Phenyl]Hydrazono]Cyclohexa-1,4-Diene-1-Carboxylic Acid
• Molecular Formula: C₃₆H₃₃N₅O₄
• Molecular Weight: 599.69
• CAS Registry Number: 188913-58-8
• SMILES: C6=C5[N](CC1CCN(CC1)C(=O)\C=C(/C3=CC=C(N\N=C2\C=C(C(=O)C=C2)C(O)=O)C=C3)C4=CC=CC=C4)C(=NC5=CC=C6)C
• InChI: 1S/C36H33N5O4/c1-24-37-32-9-5-6-10-33(32)41(24)23-25-17-19-40(20-18-25)35(43)22-30(26-7-3-2-4-8-26)27-11-13-28(14-12-27)38-39-29-15-16-34(42)31(21-29)36(44)45/h2-16,21-22,25,38H,17-20,23H2,1H3,(H,44,45)/b30-22-,39-29+
• InChIKey: BLFZTTSVDONBGS-RAGNRHJLSA-N

Properties

• Density: 1.293g/cm³ (Cal.)
• Boiling point: 843.324°C at 760 mmHg (Cal.)
• Flash point: 463.826°C (Cal.)