N,N-didodecyl-4-(2-phenylethynyl)aniline

Systemtic Name: N,N-didodecyl-4-(2-phenylethynyl)aniline Openeye Name: N,N-didodecyl-4-(2-phenylethynyl)aniline CAS Name: N,N-didodecyl-4-(2-phenylethynyl)aniline IUPAC Name: N,N-didodecyl-4-(2-phenylethynyl)aniline Traditional Name: dilauryl-[4-(2-phenylethynyl)phenyl]amine Formula: C38H59N MolecularWeight: 529.88176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=CC=C(C=C1)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=CC=C(C=C1)C#CC2=CC=CC=C2

InChI

InChI=1S/C38H59N/c1-3-5-7-9-11-13-15-17-19-24-34-39(35-25-20-18-16-14-12-10-8-6-4-2)38-32-30-37(31-33-38)29-28-36-26-22-21-23-27-36/h21-23,26-27,30-33H,3-20,24-25,34-35H2,1-2H3