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

Systemtic Name: 5-[bis(4-octylphenyl)amino]-5-(4-dimethylaminophenyl)furo[3,4-b]pyrazin-7-one Openeye Name: 5-(4-dimethylaminophenyl)-5-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyrazin-7-one CAS Name: 5-(4-dimethylaminophenyl)-5-(4-octyl-N-(4-octylphenyl)anilino)-7-furo[3,4-b]pyrazinone IUPAC Name: 5-(4-dimethylaminophenyl)-5-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyrazin-7-one Traditional Name: 5-(4-dimethylaminophenyl)-5-(4-octyl-N-(4-octylphenyl)anilino)furo[3,4-b]pyrazin-7-one Formula: C42H54N4O2 MolecularWeight: 646.90376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CCCCCCCC)C3(C4=NC=CN=C4C(=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=NC=CN=C4C(=O)O3)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C42H54N4O2/c1-5-7-9-11-13-15-17-33-19-25-37(26-20-33)46(38-27-21-34(22-28-38)18-16-14-12-10-8-6-2)42(35-23-29-36(30-24-35)45(3)4)40-39(41(47)48-42)43-31-32-44-40/h19-32H,5-18H2,1-4H3