4-[2,6-bis(2,4-dipropoxyphenyl)pyridin-3-yl]-N,N-diphenyl-aniline

Systemtic Name: 4-[2,6-bis(2,4-dipropoxyphenyl)pyridin-3-yl]-N,N-diphenyl-aniline Openeye Name: 4-[2,6-bis(2,4-dipropoxyphenyl)-3-pyridyl]-N,N-diphenyl-aniline CAS Name: 4-[2,6-bis(2,4-dipropoxyphenyl)-3-pyridinyl]-N,N-diphenylaniline IUPAC Name: 4-[2,6-bis(2,4-dipropoxyphenyl)pyridin-3-yl]-N,N-diphenylaniline Traditional Name: [4-[2,6-bis(2,4-dipropoxyphenyl)-3-pyridyl]phenyl]-diphenyl-amine Formula: C47H50N2O4 MolecularWeight: 706.9109

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C2=NC(=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=C(C=C(C=C6)OCCC)OCCC)OCCC

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C2=NC(=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=C(C=C(C=C6)OCCC)OCCC)OCCC

InChI

InChI=1S/C47H50N2O4/c1-5-29-50-39-23-25-42(45(33-39)52-31-7-3)44-28-27-41(47(48-44)43-26-24-40(51-30-6-2)34-46(43)53-32-8-4)35-19-21-38(22-20-35)49(36-15-11-9-12-16-36)37-17-13-10-14-18-37/h9-28,33-34H,5-8,29-32H2,1-4H3