3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexyl-aniline

Systemtic Name: 3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexyl-aniline Openeye Name: 3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexyl-aniline CAS Name: 3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexylaniline IUPAC Name: 3,5-bis[2-(4-bromophenyl)ethynyl]-N,N-dihexylaniline Traditional Name: [3,5-bis[2-(4-bromophenyl)ethynyl]phenyl]-dihexyl-amine Formula: C34H37Br2N MolecularWeight: 619.47228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC(=CC(=C1)C#CC2=CC=C(C=C2)Br)C#CC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC(=CC(=C1)C#CC2=CC=C(C=C2)Br)C#CC3=CC=C(C=C3)Br

InChI

InChI=1S/C34H37Br2N/c1-3-5-7-9-23-37(24-10-8-6-4-2)34-26-30(13-11-28-15-19-32(35)20-16-28)25-31(27-34)14-12-29-17-21-33(36)22-18-29/h15-22,25-27H,3-10,23-24H2,1-2H3