3,3-bis(3,4,5-trimethylbenzene-6-id-1-yl)-2-benzofuran-1-one; yttrium(3+)

Systemtic Name: 3,3-bis(3,4,5-trimethylbenzene-6-id-1-yl)-2-benzofuran-1-one; yttrium(3+) Openeye Name: 3,3-bis(3,4,5-trimethylbenzene-6-id-1-yl)isobenzofuran-1-one; yttrium(3+) CAS Name: 3,3-bis(3,4,5-trimethyl-1-benzene-6-idyl)-1-isobenzofuranone; yttrium(3+) IUPAC Name: 3,3-bis(3,4,5-trimethylbenzene-6-id-1-yl)-2-benzofuran-1-one; yttrium(3+) Traditional Name: 3,3-bis(3,4,5-trimethylbenzene-6-id-1-yl)phthalide; yttrium(3+) Formula: C26H24O2Y+ MolecularWeight: 457.37341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[C-]C(=C1C)C)C2(C3=CC=CC=C3C(=O)O2)C4=[C-]C(=C(C(=C4)C)C)C.[Y+3]

Isomeric SMILES

CC1=CC(=[C-]C(=C1C)C)C2(C3=CC=CC=C3C(=O)O2)C4=[C-]C(=C(C(=C4)C)C)C.[Y+3]

InChI

InChI=1S/C26H24O2.Y/c1-15-11-21(12-16(2)19(15)5)26(22-13-17(3)20(6)18(4)14-22)24-10-8-7-9-23(24)25(27)28-26;/h7-11,13H,1-6H3;/q-2;+3