(1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 3-methyl-4-[4-(4-methylphenyl)phenyl]carbonyloxy-benzene-2-ide-1-carboxylate; yttrium(3+)

Systemtic Name: (1-oxidanylidene-1-propan-2-yloxy-propan-2-yl) 3-methyl-4-[4-(4-methylphenyl)phenyl]carbonyloxy-benzene-2-ide-1-carboxylate; yttrium(3+) Openeye Name: (2-isopropoxy-1-methyl-2-oxo-ethyl) 3-methyl-4-[4-(p-tolyl)benzoyl]oxy-benzene-2-ide-1-carboxylate; yttrium(3+) CAS Name: 3-methyl-4-[[4-(4-methylphenyl)phenyl]-oxomethoxy]-1-benzene-2-idecarboxylic acid (1-oxo-1-propan-2-yloxypropan-2-yl) ester; yttrium(3+) IUPAC Name: (1-oxo-1-propan-2-yloxypropan-2-yl) 3-methyl-4-[4-(4-methylphenyl)benzoyl]oxybenzene-2-ide-1-carboxylate; yttrium(3+) Traditional Name: 3-methyl-4-[4-(p-tolyl)benzoyl]oxy-benzene-2-ide-1-carboxylic acid (2-isopropoxy-2-keto-1-methyl-ethyl) ester; yttrium(3+) Formula: C28H27O6Y+2 MolecularWeight: 548.41623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C([C-]=C(C=C3)C(=O)OC(C)C(=O)OC(C)C)C.[Y+3]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C([C-]=C(C=C3)C(=O)OC(C)C(=O)OC(C)C)C.[Y+3]

InChI

InChI=1S/C28H27O6.Y/c1-17(2)32-26(29)20(5)33-28(31)24-14-15-25(19(4)16-24)34-27(30)23-12-10-22(11-13-23)21-8-6-18(3)7-9-21;/h6-15,17,20H,1-5H3;/q-1;+3