(4-methoxy-3-methyl-benzene-6-id-1-yl) 3-oxidanylidenebutanoate; yttrium(3+)

Systemtic Name: (4-methoxy-3-methyl-benzene-6-id-1-yl) 3-oxidanylidenebutanoate; yttrium(3+) Openeye Name: (4-methoxy-3-methyl-benzene-6-id-1-yl) 3-oxobutanoate; yttrium(3+) CAS Name: 3-oxobutanoic acid (4-methoxy-3-methyl-1-benzene-6-idyl) ester; yttrium(3+) IUPAC Name: (4-methoxy-3-methylbenzene-6-id-1-yl) 3-oxobutanoate; yttrium(3+) Traditional Name: 3-ketobutyric acid (4-methoxy-3-methyl-benzene-6-id-1-yl) ester; yttrium(3+) Formula: C12H13O4Y+2 MolecularWeight: 310.13507

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13O4.Y/c1-8-6-10(4-5-11(8)15-3)16-12(14)7-9(2)13;/h5-6H,7H2,1-3H3;/q-1;+3