N9,N10-bis(4-methylphenyl)-N9,N10-bis(4-propylphenyl)phenanthrene-9,10-diamine

Systemtic Name: N9,N10-bis(4-methylphenyl)-N9,N10-bis(4-propylphenyl)phenanthrene-9,10-diamine Openeye Name: N9,N10-bis(4-propylphenyl)-N9,N10-bis(p-tolyl)phenanthrene-9,10-diamine CAS Name: N9,N10-bis(4-methylphenyl)-N9,N10-bis(4-propylphenyl)phenanthrene-9,10-diamine IUPAC Name: 9-N,10-N-bis(4-methylphenyl)-9-N,10-N-bis(4-propylphenyl)phenanthrene-9,10-diamine Traditional Name: [10-(4-methyl-N-(4-propylphenyl)anilino)-9-phenanthryl]-(4-propylphenyl)-(p-tolyl)amine Formula: C46H44N2 MolecularWeight: 624.85496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=C(C4=CC=CC=C4C5=CC=CC=C53)N(C6=CC=C(C=C6)C)C7=CC=C(C=C7)CCC

Isomeric SMILES

CCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=C(C4=CC=CC=C4C5=CC=CC=C53)N(C6=CC=C(C=C6)C)C7=CC=C(C=C7)CCC

InChI

InChI=1S/C46H44N2/c1-5-11-35-21-29-39(30-22-35)47(37-25-17-33(3)18-26-37)45-43-15-9-7-13-41(43)42-14-8-10-16-44(42)46(45)48(38-27-19-34(4)20-28-38)40-31-23-36(12-6-2)24-32-40/h7-10,13-32H,5-6,11-12H2,1-4H3