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

Systemtic Name: 4-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]butanenitrile Openeye Name: 4-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methoxy]butanenitrile CAS Name: 4-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]butanenitrile IUPAC Name: 4-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]butanenitrile Traditional Name: 4-(4-acetyl-3-hydroxy-2-propyl-benzyl)oxybutyronitrile Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COCCCC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COCCCC#N

InChI

InChI=1S/C16H21NO3/c1-3-6-15-13(11-20-10-5-4-9-17)7-8-14(12(2)18)16(15)19/h7-8,19H,3-6,10-11H2,1-2H3