2-[[4-[2-(4-cyclohexylphenoxy)ethyl-ethyl-amino]-2-methyl-phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[4-[2-(4-cyclohexylphenoxy)ethyl-ethyl-amino]-2-methyl-phenyl]methylidene]propanedinitrile Openeye Name: 2-[[4-[2-(4-cyclohexylphenoxy)ethyl-ethyl-amino]-2-methyl-phenyl]methylene]propanedinitrile CAS Name: 2-[[4-[2-(4-cyclohexylphenoxy)ethyl-ethylamino]-2-methylphenyl]methylidene]propanedinitrile IUPAC Name: 2-[[4-[2-(4-cyclohexylphenoxy)ethyl-ethylamino]-2-methylphenyl]methylidene]propanedinitrile Traditional Name: 2-[4-[2-(4-cyclohexylphenoxy)ethyl-ethyl-amino]-2-methyl-benzylidene]malononitrile Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC1=CC=C(C=C1)C2CCCCC2)C3=CC(=C(C=C3)C=C(C#N)C#N)C

Isomeric SMILES

CCN(CCOC1=CC=C(C=C1)C2CCCCC2)C3=CC(=C(C=C3)C=C(C#N)C#N)C

InChI

InChI=1S/C27H31N3O/c1-3-30(26-12-9-25(21(2)17-26)18-22(19-28)20-29)15-16-31-27-13-10-24(11-14-27)23-7-5-4-6-8-23/h9-14,17-18,23H,3-8,15-16H2,1-2H3