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

Systemtic Name: 3,3-bis[3-(dimethylaminomethyl)-4-oxidanyl-phenyl]-2-benzofuran-1-one Openeye Name: 3,3-bis[3-(dimethylaminomethyl)-4-hydroxy-phenyl]isobenzofuran-1-one CAS Name: 3,3-bis[3-(dimethylaminomethyl)-4-hydroxyphenyl]-1-isobenzofuranone IUPAC Name: 3,3-bis[3-(dimethylaminomethyl)-4-hydroxyphenyl]-2-benzofuran-1-one Traditional Name: 3,3-bis[3-(dimethylaminomethyl)-4-hydroxy-phenyl]phthalide Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4)O)CN(C)C)O

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4)O)CN(C)C)O

InChI

InChI=1S/C26H28N2O4/c1-27(2)15-17-13-19(9-11-23(17)29)26(22-8-6-5-7-21(22)25(31)32-26)20-10-12-24(30)18(14-20)16-28(3)4/h5-14,29-30H,15-16H2,1-4H3