4-[4-[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]oxyphenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]oxyphenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(3-chlorophenyl)-1-methyl-2-oxo-ethoxy]phenyl]benzonitrile CAS Name: 4-[4-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxyphenyl]benzonitrile IUPAC Name: 4-[4-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxyphenyl]benzonitrile Traditional Name: 4-[4-[2-(3-chlorophenyl)-2-keto-1-methyl-ethoxy]phenyl]benzonitrile Formula: C22H16ClNO2 MolecularWeight: 361.82094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=CC=C1)Cl)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C(=O)C1=CC(=CC=C1)Cl)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H16ClNO2/c1-15(22(25)19-3-2-4-20(23)13-19)26-21-11-9-18(10-12-21)17-7-5-16(14-24)6-8-17/h2-13,15H,1H3