5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]pentanenitrile

Systemtic Name: 5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]pentanenitrile Openeye Name: 5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]pentanenitrile CAS Name: 5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]pentanenitrile IUPAC Name: 5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]pentanenitrile Traditional Name: 5-[2-(4-cyanobutyl)-3-(4-phenylphenyl)phenyl]valeronitrile Formula: C28H28N2 MolecularWeight: 392.53532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=CC=C3)CCCCC#N)CCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=CC=C3)CCCCC#N)CCCCC#N

InChI

InChI=1S/C28H28N2/c29-21-8-2-6-13-25-14-10-16-28(27(25)15-7-3-9-22-30)26-19-17-24(18-20-26)23-11-4-1-5-12-23/h1,4-5,10-12,14,16-20H,2-3,6-9,13,15H2