2-[(E)-4-butyl-1-phenyl-non-4-enyl]propanedinitrile

Systemtic Name: 2-[(E)-4-butyl-1-phenyl-non-4-enyl]propanedinitrile Openeye Name: 2-[(E)-4-butyl-1-phenyl-non-4-enyl]propanedinitrile CAS Name: 2-[(E)-4-butyl-1-phenylnon-4-enyl]propanedinitrile IUPAC Name: 2-[(E)-4-butyl-1-phenylnon-4-enyl]propanedinitrile Traditional Name: 2-[(E)-4-butyl-1-phenyl-non-4-enyl]malononitrile Formula: C22H30N2 MolecularWeight: 322.487

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(CCCC)CCC(C1=CC=CC=C1)C(C#N)C#N

Isomeric SMILES

CCCC/C=C(\CCCC)/CCC(C1=CC=CC=C1)C(C#N)C#N

InChI

InChI=1S/C22H30N2/c1-3-5-8-12-19(11-6-4-2)15-16-22(21(17-23)18-24)20-13-9-7-10-14-20/h7,9-10,12-14,21-22H,3-6,8,11,15-16H2,1-2H3/b19-12+