7-[bis(4-octylphenyl)amino]-7-(4-dimethylaminophenyl)furo[3,4-b]pyridin-5-one

Systemtic Name: 7-[bis(4-octylphenyl)amino]-7-(4-dimethylaminophenyl)furo[3,4-b]pyridin-5-one Openeye Name: 7-(4-dimethylaminophenyl)-7-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyridin-5-one CAS Name: 7-(4-dimethylaminophenyl)-7-(4-octyl-N-(4-octylphenyl)anilino)-5-furo[3,4-b]pyridinone IUPAC Name: 7-(4-dimethylaminophenyl)-7-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyridin-5-one Traditional Name: 7-(4-dimethylaminophenyl)-7-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyridin-5-one Formula: C43H55N3O2 MolecularWeight: 645.9157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CCCCCCCC)C3(C4=C(C=CC=N4)C(=O)O3)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CCCCCCCC)C3(C4=C(C=CC=N4)C(=O)O3)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C43H55N3O2/c1-5-7-9-11-13-15-18-34-21-27-38(28-22-34)46(39-29-23-35(24-30-39)19-16-14-12-10-8-6-2)43(36-25-31-37(32-26-36)45(3)4)41-40(42(47)48-43)20-17-33-44-41/h17,20-33H,5-16,18-19H2,1-4H3