3-[bis(4-octylphenyl)amino]-3-(1-ethyl-2-methyl-indol-3-yl)-2-benzofuran-1-one

Systemtic Name: 3-[bis(4-octylphenyl)amino]-3-(1-ethyl-2-methyl-indol-3-yl)-2-benzofuran-1-one Openeye Name: 3-(1-ethyl-2-methyl-indol-3-yl)-3-(4-octyl-N-(4-octylphenyl)anilino)isobenzofuran-1-one CAS Name: 3-(1-ethyl-2-methyl-3-indolyl)-3-(4-octyl-N-(4-octylphenyl)anilino)-1-isobenzofuranone IUPAC Name: 3-(1-ethyl-2-methylindol-3-yl)-3-(4-octyl-N-(4-octylphenyl)anilino)-2-benzofuran-1-one Traditional Name: 3-(1-ethyl-2-methyl-indol-3-yl)-3-(4-octyl-N-(4-octylphenyl)anilino)phthalide Formula: C47H58N2O2 MolecularWeight: 682.97562

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=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CC)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)N(C2=CC=C(C=C2)CCCCCCCC)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CC)C

InChI

InChI=1S/C47H58N2O2/c1-5-8-10-12-14-16-22-37-28-32-39(33-29-37)49(40-34-30-38(31-35-40)23-17-15-13-11-9-6-2)47(43-26-20-18-24-41(43)46(50)51-47)45-36(4)48(7-3)44-27-21-19-25-42(44)45/h18-21,24-35H,5-17,22-23H2,1-4H3