2-octyl-3-phenyl-benzenecarbonitrile

Systemtic Name: 2-octyl-3-phenyl-benzenecarbonitrile Openeye Name: 2-octyl-3-phenyl-benzonitrile CAS Name: 2-octyl-3-phenylbenzonitrile IUPAC Name: 2-octyl-3-phenylbenzonitrile Traditional Name: 2-octyl-3-phenyl-benzonitrile Formula: C21H25N MolecularWeight: 291.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC=C1C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCCCCCC1=C(C=CC=C1C2=CC=CC=C2)C#N

InChI

InChI=1S/C21H25N/c1-2-3-4-5-6-10-15-21-19(17-22)14-11-16-20(21)18-12-8-7-9-13-18/h7-9,11-14,16H,2-6,10,15H2,1H3