2,4-bis[azanyl(phenyl)methyl]-N,N,3-trioctyl-aniline

Systemtic Name: 2,4-bis[azanyl(phenyl)methyl]-N,N,3-trioctyl-aniline Openeye Name: 2,4-bis[amino(phenyl)methyl]-N,N,3-trioctyl-aniline CAS Name: 2,4-bis[amino(phenyl)methyl]-N,N,3-trioctylaniline IUPAC Name: 2,4-bis[amino(phenyl)methyl]-N,N,3-trioctylaniline Traditional Name: [2,4-bis[amino(phenyl)methyl]-3-octyl-phenyl]-dioctyl-amine Formula: C44H69N3 MolecularWeight: 640.03876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC(=C1C(C2=CC=CC=C2)N)N(CCCCCCCC)CCCCCCCC)C(C3=CC=CC=C3)N

Isomeric SMILES

CCCCCCCCC1=C(C=CC(=C1C(C2=CC=CC=C2)N)N(CCCCCCCC)CCCCCCCC)C(C3=CC=CC=C3)N

InChI

InChI=1S/C44H69N3/c1-4-7-10-13-16-25-32-39-40(43(45)37-28-21-19-22-29-37)33-34-41(42(39)44(46)38-30-23-20-24-31-38)47(35-26-17-14-11-8-5-2)36-27-18-15-12-9-6-3/h19-24,28-31,33-34,43-44H,4-18,25-27,32,35-36,45-46H2,1-3H3