N,N-didodecyl-4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]aniline

Systemtic Name: N,N-didodecyl-4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]aniline Openeye Name: N,N-didodecyl-4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]aniline CAS Name: N,N-didodecyl-4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]aniline IUPAC Name: N,N-didodecyl-4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]aniline Traditional Name: dilauryl-[4-[2-[4-[2-(4-nitrophenyl)ethynyl]phenyl]ethynyl]phenyl]amine Formula: C46H62N2O2 MolecularWeight: 674.99668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C46H62N2O2/c1-3-5-7-9-11-13-15-17-19-21-39-47(40-22-20-18-16-14-12-10-8-6-4-2)45-35-31-43(32-36-45)29-27-41-23-25-42(26-24-41)28-30-44-33-37-46(38-34-44)48(49)50/h23-26,31-38H,3-22,39-40H2,1-2H3