Cromitrile
[CAS# 53736-52-0]

Identification

• Name: Cromitrile
• Synonyms: Sodium 4-[2-Hydroxy-3-[4-Oxo-2-(2,3,4-Triaza-1-Azanidacyclopenta-2,4-Dien-5-Yl)Chromen-5-Yl]Oxypropoxy]Benzonitrile; Sodium 4-[2-Hydroxy-3-[4-Oxo-2-(2,3,4-Triaza-1-Azanidacyclopenta-2,4-Dien-5-Yl)Chromen-5-Yl]Oxy-Propoxy]Benzonitrile; Sodium 5-[3-(4-Cyanophenoxy)-2-Hydroxy-Propoxy]-2-(Tetrazol-5-Ylidene)Chromen-4-Olate
• Molecular Formula: C₂₀H₁₄N₅NaO₅
• Molecular Weight: 427.35
• CAS Registry Number: 53736-52-0
• SMILES: [N-]4N=C(C1=CC(C2=C(O1)C=CC=C2OCC(COC3=CC=C(C#N)C=C3)O)=O)N=N4.[Na+]
• InChI: 1S/C20H15N5O5.Na/c21-9-12-4-6-14(7-5-12)28-10-13(26)11-29-16-2-1-3-17-19(16)15(27)8-18(30-17)20-22-24-25-23-20;/h1-8,13,26H,10-11H2,(H,22,23,24,25,27);/q;+1/p-1
• InChIKey: DRMAOJOMESIGKD-UHFFFAOYSA-M