N5,N6-diphenylheptadec-7-yne-5,6-diimine

Systemtic Name: N5,N6-diphenylheptadec-7-yne-5,6-diimine Openeye Name: N5,N6-diphenylheptadec-7-yne-5,6-diimine CAS Name: N5,N6-diphenyl-7-heptadecyne-5,6-diimine IUPAC Name: 5-N,6-N-diphenylheptadec-7-yne-5,6-diimine Traditional Name: 1-(C-butyl-N-phenyl-carbonimidoyl)dodec-2-ynylidene-phenyl-amine Formula: C29H38N2 MolecularWeight: 414.62542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC#CC(=NC1=CC=CC=C1)C(=NC2=CC=CC=C2)CCCC

Isomeric SMILES

CCCCCCCCCC#CC(=NC1=CC=CC=C1)C(=NC2=CC=CC=C2)CCCC

InChI

InChI=1S/C29H38N2/c1-3-5-7-8-9-10-11-12-19-25-29(31-27-22-17-14-18-23-27)28(24-6-4-2)30-26-20-15-13-16-21-26/h13-18,20-23H,3-12,24H2,1-2H3