3-[4-(dibutylamino)-2-oxidanyl-phenyl]-3-(2-methoxy-4-methyl-5-phenylazanyl-phenyl)-2-benzofuran-1-one

Systemtic Name: 3-[4-(dibutylamino)-2-oxidanyl-phenyl]-3-(2-methoxy-4-methyl-5-phenylazanyl-phenyl)-2-benzofuran-1-one Openeye Name: 3-(5-anilino-2-methoxy-4-methyl-phenyl)-3-[4-(dibutylamino)-2-hydroxy-phenyl]isobenzofuran-1-one CAS Name: 3-(5-anilino-2-methoxy-4-methylphenyl)-3-[4-(dibutylamino)-2-hydroxyphenyl]-1-isobenzofuranone IUPAC Name: 3-(5-anilino-2-methoxy-4-methylphenyl)-3-[4-(dibutylamino)-2-hydroxyphenyl]-2-benzofuran-1-one Traditional Name: 3-(5-anilino-2-methoxy-4-methyl-phenyl)-3-[4-(dibutylamino)-2-hydroxy-phenyl]phthalide Formula: C36H40N2O4 MolecularWeight: 564.7138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4OC)C)NC5=CC=CC=C5)O

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4OC)C)NC5=CC=CC=C5)O

InChI

InChI=1S/C36H40N2O4/c1-5-7-20-38(21-8-6-2)27-18-19-30(33(39)23-27)36(29-17-13-12-16-28(29)35(40)42-36)31-24-32(25(3)22-34(31)41-4)37-26-14-10-9-11-15-26/h9-19,22-24,37,39H,5-8,20-21H2,1-4H3