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

Systemtic Name: 3-[bis(4-octylphenyl)amino]-3-[4-(diethylamino)-2-methyl-phenyl]-2-benzofuran-1-one Openeye Name: 3-[4-(diethylamino)-2-methyl-phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)isobenzofuran-1-one CAS Name: 3-[4-(diethylamino)-2-methylphenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)-1-isobenzofuranone IUPAC Name: 3-[4-(diethylamino)-2-methylphenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)-2-benzofuran-1-one Traditional Name: 3-[4-(diethylamino)-2-methyl-phenyl]-3-(4-octyl-N-(4-octylphenyl)anilino)phthalide Formula: C47H62N2O2 MolecularWeight: 687.00738

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

InChI

InChI=1S/C47H62N2O2/c1-6-10-12-14-16-18-22-38-26-30-40(31-27-38)49(41-32-28-39(29-33-41)23-19-17-15-13-11-7-2)47(45-25-21-20-24-43(45)46(50)51-47)44-35-34-42(36-37(44)5)48(8-3)9-4/h20-21,24-36H,6-19,22-23H2,1-5H3