3-tert-butyl-N6,N12-bis(4-tert-butylphenyl)-N6,N12-bis(3,4-dimethylphenyl)chrysene-6,12-diamine

Systemtic Name: 3-tert-butyl-N6,N12-bis(4-tert-butylphenyl)-N6,N12-bis(3,4-dimethylphenyl)chrysene-6,12-diamine Openeye Name: 3-tert-butyl-N6,N12-bis(4-tert-butylphenyl)-N6,N12-bis(3,4-dimethylphenyl)chrysene-6,12-diamine CAS Name: 3-tert-butyl-N6,N12-bis(4-tert-butylphenyl)-N6,N12-bis(3,4-dimethylphenyl)chrysene-6,12-diamine IUPAC Name: 3-tert-butyl-6-N,12-N-bis(4-tert-butylphenyl)-6-N,12-N-bis(3,4-dimethylphenyl)chrysene-6,12-diamine Traditional Name: [3-tert-butyl-12-(4-tert-butyl-N-(3,4-dimethylphenyl)anilino)chrysen-6-yl]-(4-tert-butylphenyl)-(3,4-dimethylphenyl)amine Formula: C58H62N2 MolecularWeight: 787.12628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=CC=C(C=C2)C(C)(C)C)C3=CC4=C5C=C(C=CC5=C(C=C4C6=CC=CC=C63)N(C7=CC=C(C=C7)C(C)(C)C)C8=CC(=C(C=C8)C)C)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=CC=C(C=C2)C(C)(C)C)C3=CC4=C5C=C(C=CC5=C(C=C4C6=CC=CC=C63)N(C7=CC=C(C=C7)C(C)(C)C)C8=CC(=C(C=C8)C)C)C(C)(C)C)C

InChI

InChI=1S/C58H62N2/c1-37-18-25-46(32-39(37)3)59(44-27-20-41(21-28-44)56(5,6)7)54-36-53-51-34-43(58(11,12)13)24-31-50(51)55(35-52(53)48-16-14-15-17-49(48)54)60(47-26-19-38(2)40(4)33-47)45-29-22-42(23-30-45)57(8,9)10/h14-36H,1-13H3