2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile; docosyl(triethyl)phosphanium

Systemtic Name: 2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile; docosyl(triethyl)phosphanium Openeye Name: 2-[4-(dicyanomethylene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile; docosyl(triethyl)phosphonium CAS Name: 2-[4-(dicyanomethylidene)-1-cyclohexa-2,5-dienylidene]propanedinitrile; docosyl(triethyl)phosphonium IUPAC Name: 2-[4-(dicyanomethylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile; docosyl(triethyl)phosphanium Traditional Name: behenyl(triethyl)phosphonium; 2-[4-(dicyanomethylene)cyclohexa-2,5-dien-1-ylidene]malononitrile Formula: C40H64N4P+ MolecularWeight: 631.936721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC[P+](CC)(CC)CC.C1=CC(=C(C#N)C#N)C=CC1=C(C#N)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[P+](CC)(CC)CC.C1=CC(=C(C#N)C#N)C=CC1=C(C#N)C#N

InChI

InChI=1S/C28H60P.C12H4N4/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(6-2,7-3)8-4;13-5-11(6-14)9-1-2-10(4-3-9)12(7-15)8-16/h5-28H2,1-4H3;1-4H/q+1;