benzene-1,3-dicarboxylic acid; (Z)-4-oxidanylpent-3-en-2-one; ruthenium

Systemtic Name: benzene-1,3-dicarboxylic acid; (Z)-4-oxidanylpent-3-en-2-one; ruthenium Openeye Name: (Z)-4-hydroxypent-3-en-2-one; isophthalic acid; ruthenium CAS Name: benzene-1,3-dicarboxylic acid; (Z)-4-hydroxy-3-penten-2-one; ruthenium IUPAC Name: benzene-1,3-dicarboxylic acid; (Z)-4-hydroxypent-3-en-2-one; ruthenium Traditional Name: (Z)-4-hydroxypent-3-en-2-one; isophthalic acid; ruthenium Formula: C28H38O12Ru2 MolecularWeight: 768.73412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.[Ru].[Ru]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.[Ru].[Ru]

InChI

InChI=1S/C8H6O4.4C5H8O2.2Ru/c9-7(10)5-2-1-3-6(4-5)8(11)12;4*1-4(6)3-5(2)7;;/h1-4H,(H,9,10)(H,11,12);4*3,6H,1-2H3;;/b;4*4-3-;;