3,3-bis[3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl]-2-benzofuran-1-one

Systemtic Name: 3,3-bis[3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl]-2-benzofuran-1-one Openeye Name: 3,3-bis[3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl]isobenzofuran-1-one CAS Name: 3,3-bis[3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl]-1-isobenzofuranone IUPAC Name: 3,3-bis[3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl]-2-benzofuran-1-one Traditional Name: 3,3-bis[3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl]phthalide Formula: C32H42N4O4 MolecularWeight: 546.70028

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC(=C1O)CN(C)C)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)CN(C)C)O)CN(C)C

Isomeric SMILES

CN(C)CC1=CC(=CC(=C1O)CN(C)C)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C(=C4)CN(C)C)O)CN(C)C

InChI

InChI=1S/C32H42N4O4/c1-33(2)17-21-13-25(14-22(29(21)37)18-34(3)4)32(28-12-10-9-11-27(28)31(39)40-32)26-15-23(19-35(5)6)30(38)24(16-26)20-36(7)8/h9-16,37-38H,17-20H2,1-8H3