3-[bis(4-octylphenyl)amino]-6-(dimethylamino)-3-(4-dimethylaminophenyl)-2-benzofuran-1-one

Systemtic Name: 3-[bis(4-octylphenyl)amino]-6-(dimethylamino)-3-(4-dimethylaminophenyl)-2-benzofuran-1-one Openeye Name: 6-(dimethylamino)-3-(4-dimethylaminophenyl)-3-(4-octyl-N-(4-octylphenyl)anilino)isobenzofuran-1-one CAS Name: 6-(dimethylamino)-3-(4-dimethylaminophenyl)-3-(4-octyl-N-(4-octylphenyl)anilino)-1-isobenzofuranone IUPAC Name: 6-(dimethylamino)-3-(4-dimethylaminophenyl)-3-(4-octyl-N-(4-octylphenyl)anilino)-2-benzofuran-1-one Traditional Name: 6-(dimethylamino)-3-(4-dimethylaminophenyl)-3-(4-octyl-N-(4-octylphenyl)anilino)phthalide Formula: C46H61N3O2 MolecularWeight: 687.99544

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C46H61N3O2/c1-7-9-11-13-15-17-19-36-21-27-40(28-22-36)49(41-29-23-37(24-30-41)20-18-16-14-12-10-8-2)46(38-25-31-39(32-26-38)47(3)4)44-34-33-42(48(5)6)35-43(44)45(50)51-46/h21-35H,7-20H2,1-6H3