4-[(4-azanyl-3-octyl-phenyl)methyl]-2-octyl-aniline

Systemtic Name: 4-[(4-azanyl-3-octyl-phenyl)methyl]-2-octyl-aniline Openeye Name: 4-[(4-amino-3-octyl-phenyl)methyl]-2-octyl-aniline CAS Name: 4-[(4-amino-3-octylphenyl)methyl]-2-octylaniline IUPAC Name: 4-[(4-amino-3-octylphenyl)methyl]-2-octylaniline Traditional Name: [4-(4-amino-3-octyl-benzyl)-2-octyl-phenyl]amine Formula: C29H46N2 MolecularWeight: 422.68894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)CCCCCCCC)N

Isomeric SMILES

CCCCCCCCC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)CCCCCCCC)N

InChI

InChI=1S/C29H46N2/c1-3-5-7-9-11-13-15-26-22-24(17-19-28(26)30)21-25-18-20-29(31)27(23-25)16-14-12-10-8-6-4-2/h17-20,22-23H,3-16,21,30-31H2,1-2H3