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

Systemtic Name: 3-[4-methoxy-3-(2-methylpropoxy)phenyl]-3-oxidanyl-butanenitrile Openeye Name: 3-hydroxy-3-(3-isobutoxy-4-methoxy-phenyl)butanenitrile CAS Name: 3-hydroxy-3-[4-methoxy-3-(2-methylpropoxy)phenyl]butanenitrile IUPAC Name: 3-hydroxy-3-[4-methoxy-3-(2-methylpropoxy)phenyl]butanenitrile Traditional Name: 3-hydroxy-3-(3-isobutoxy-4-methoxy-phenyl)butyronitrile Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)C(C)(CC#N)O)OC

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)C(C)(CC#N)O)OC

InChI

InChI=1S/C15H21NO3/c1-11(2)10-19-14-9-12(5-6-13(14)18-4)15(3,17)7-8-16/h5-6,9,11,17H,7,10H2,1-4H3