3-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]benzenecarbonitrile

Systemtic Name: 3-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]benzenecarbonitrile Openeye Name: 3-[3,5-dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]benzonitrile CAS Name: 3-[3,5-dimethyl-4-[3-(3-methyl-5-isoxazolyl)propoxy]phenyl]benzonitrile IUPAC Name: 3-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]benzonitrile Traditional Name: 3-[3,5-dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl]benzonitrile Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H22N2O2/c1-15-10-20(19-7-4-6-18(13-19)14-23)11-16(2)22(15)25-9-5-8-21-12-17(3)24-26-21/h4,6-7,10-13H,5,8-9H2,1-3H3