4-[4-(4-ethanoyl-3-oxidanyl-2-pentyl-phenoxy)butoxy]benzenecarbonitrile

Systemtic Name: 4-[4-(4-ethanoyl-3-oxidanyl-2-pentyl-phenoxy)butoxy]benzenecarbonitrile Openeye Name: 4-[4-(4-acetyl-3-hydroxy-2-pentyl-phenoxy)butoxy]benzonitrile CAS Name: 4-[4-(4-acetyl-3-hydroxy-2-pentylphenoxy)butoxy]benzonitrile IUPAC Name: 4-[4-(4-acetyl-3-hydroxy-2-pentylphenoxy)butoxy]benzonitrile Traditional Name: 4-[4-(4-acetyl-2-amyl-3-hydroxy-phenoxy)butoxy]benzonitrile Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C24H29NO4/c1-3-4-5-8-22-23(14-13-21(18(2)26)24(22)27)29-16-7-6-15-28-20-11-9-19(17-25)10-12-20/h9-14,27H,3-8,15-16H2,1-2H3