2-[4-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methoxy]phenyl]acetonitrile CAS Name: 2-[4-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]phenyl]acetonitrile Traditional Name: 2-[4-(4-acetyl-3-hydroxy-2-propyl-benzyl)oxyphenyl]acetonitrile Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=C(C=C2)CC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C20H21NO3/c1-3-4-19-16(7-10-18(14(2)22)20(19)23)13-24-17-8-5-15(6-9-17)11-12-21/h5-10,23H,3-4,11,13H2,1-2H3