4-[[4-[7-(hydroxymethyl)-8-oxidanyl-octoxy]phenyl]diazenyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[7-(hydroxymethyl)-8-oxidanyl-octoxy]phenyl]diazenyl]benzenecarbonitrile Openeye Name: 4-[4-[8-hydroxy-7-(hydroxymethyl)octoxy]phenyl]azobenzonitrile CAS Name: 4-[4-[8-hydroxy-7-(hydroxymethyl)octoxy]phenyl]azobenzonitrile IUPAC Name: 4-[[4-[8-hydroxy-7-(hydroxymethyl)octoxy]phenyl]diazenyl]benzonitrile Traditional Name: 4-[4-(8-hydroxy-7-methylol-octoxy)phenyl]azobenzonitrile Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N=NC2=CC=C(C=C2)OCCCCCCC(CO)CO

Isomeric SMILES

C1=CC(=CC=C1C#N)N=NC2=CC=C(C=C2)OCCCCCCC(CO)CO

InChI

InChI=1S/C22H27N3O3/c23-15-18-6-8-20(9-7-18)24-25-21-10-12-22(13-11-21)28-14-4-2-1-3-5-19(16-26)17-27/h6-13,19,26-27H,1-5,14,16-17H2