3-[bis(4-octylphenyl)amino]-3-[4-(diethylamino)phenyl]-2-benzofuran-1-one

Systemtic Name: 3-[bis(4-octylphenyl)amino]-3-[4-(diethylamino)phenyl]-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)phthalide Formula: C46H60N2O2 MolecularWeight: 672.9808

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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=CC=C(C=C5)N(CC)CC

Isomeric SMILES

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

InChI

InChI=1S/C46H60N2O2/c1-5-9-11-13-15-17-21-37-25-31-41(32-26-37)48(42-33-27-38(28-34-42)22-18-16-14-12-10-6-2)46(44-24-20-19-23-43(44)45(49)50-46)39-29-35-40(36-30-39)47(7-3)8-4/h19-20,23-36H,5-18,21-22H2,1-4H3