3-[4-(4-chlorophenyl)carbonylphenoxy]propanenitrile

Systemtic Name: 3-[4-(4-chlorophenyl)carbonylphenoxy]propanenitrile Openeye Name: 3-[4-(4-chlorobenzoyl)phenoxy]propanenitrile CAS Name: 3-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]propanenitrile IUPAC Name: 3-[4-(4-chlorobenzoyl)phenoxy]propanenitrile Traditional Name: 3-[4-(4-chlorobenzoyl)phenoxy]propionitrile Formula: C16H12ClNO2 MolecularWeight: 285.72498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)OCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)OCCC#N

InChI

InChI=1S/C16H12ClNO2/c17-14-6-2-12(3-7-14)16(19)13-4-8-15(9-5-13)20-11-1-10-18/h2-9H,1,11H2