N2,N3-bis(3,4-dipentylphenyl)henicos-4-yne-2,3-diimine

Systemtic Name: N2,N3-bis(3,4-dipentylphenyl)henicos-4-yne-2,3-diimine Openeye Name: N2,N3-bis(3,4-dipentylphenyl)henicos-4-yne-2,3-diimine CAS Name: N2,N3-bis(3,4-dipentylphenyl)-4-heneicosyne-2,3-diimine IUPAC Name: 2-N,3-N-bis(3,4-dipentylphenyl)henicos-4-yne-2,3-diimine Traditional Name: (3,4-diamylphenyl)-[2-(3,4-diamylphenyl)imino-1-methyl-eicos-3-ynylidene]amine Formula: C53H86N2 MolecularWeight: 751.26334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC#CC(=NC1=CC(=C(C=C1)CCCCC)CCCCC)C(=NC2=CC(=C(C=C2)CCCCC)CCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC#CC(=NC1=CC(=C(C=C1)CCCCC)CCCCC)C(=NC2=CC(=C(C=C2)CCCCC)CCCCC)C

InChI

InChI=1S/C53H86N2/c1-7-12-17-18-19-20-21-22-23-24-25-26-27-28-29-34-39-53(55-52-43-41-48(36-31-14-9-3)50(45-52)38-33-16-11-5)46(6)54-51-42-40-47(35-30-13-8-2)49(44-51)37-32-15-10-4/h40-45H,7-33,35-38H2,1-6H3