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

Systemtic Name: 4-[4-(4-ethanoyl-2-methyl-3-oxidanyl-phenoxy)butoxy]benzenecarbonitrile Openeye Name: 4-[4-(4-acetyl-3-hydroxy-2-methyl-phenoxy)butoxy]benzonitrile CAS Name: 4-[4-(4-acetyl-3-hydroxy-2-methylphenoxy)butoxy]benzonitrile IUPAC Name: 4-[4-(4-acetyl-3-hydroxy-2-methylphenoxy)butoxy]benzonitrile Traditional Name: 4-[4-(4-acetyl-3-hydroxy-2-methyl-phenoxy)butoxy]benzonitrile Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C(C=CC(=C1O)C(=O)C)OCCCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H21NO4/c1-14-19(10-9-18(15(2)22)20(14)23)25-12-4-3-11-24-17-7-5-16(13-21)6-8-17/h5-10,23H,3-4,11-12H2,1-2H3