4-[2-[4-(diphenylamino)-3-methyl-phenyl]-2-adamantyl]-2-methyl-N,N-diphenyl-aniline

Systemtic Name: 4-[2-[4-(diphenylamino)-3-methyl-phenyl]-2-adamantyl]-2-methyl-N,N-diphenyl-aniline Openeye Name: 2-methyl-4-[2-[3-methyl-4-(N-phenylanilino)phenyl]-2-adamantyl]-N,N-diphenyl-aniline CAS Name: 2-methyl-4-[2-[3-methyl-4-(N-phenylanilino)phenyl]-2-adamantyl]-N,N-diphenylaniline IUPAC Name: 2-methyl-4-[2-[3-methyl-4-(N-phenylanilino)phenyl]-2-adamantyl]-N,N-diphenylaniline Traditional Name: [2-methyl-4-[2-[3-methyl-4-(N-phenylanilino)phenyl]-2-adamantyl]phenyl]-diphenyl-amine Formula: C48H46N2 MolecularWeight: 650.89224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(C3CC4CC(C3)CC2C4)C5=CC(=C(C=C5)N(C6=CC=CC=C6)C7=CC=CC=C7)C)N(C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

CC1=C(C=CC(=C1)C2(C3CC4CC(C3)CC2C4)C5=CC(=C(C=C5)N(C6=CC=CC=C6)C7=CC=CC=C7)C)N(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C48H46N2/c1-34-27-38(23-25-46(34)49(42-15-7-3-8-16-42)43-17-9-4-10-18-43)48(40-30-36-29-37(32-40)33-41(48)31-36)39-24-26-47(35(2)28-39)50(44-19-11-5-12-20-44)45-21-13-6-14-22-45/h3-28,36-37,40-41H,29-33H2,1-2H3