tetracesium 4-(3,4-dicarboxylatophenyl)carbonylphthalate

Systemtic Name: tetracesium 4-(3,4-dicarboxylatophenyl)carbonylphthalate Openeye Name: tetracesium 4-(3,4-dicarboxylatobenzoyl)phthalate CAS Name: tetracesium 4-[(3,4-dicarboxylatophenyl)-oxomethyl]phthalate IUPAC Name: tetracesium 4-(3,4-dicarboxylatobenzoyl)phthalate Traditional Name: tetracesium 4-(3,4-dicarboxylatobenzoyl)phthalate Formula: C17H6Cs4O9 MolecularWeight: 885.84594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cs+].[Cs+].[Cs+].[Cs+]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cs+].[Cs+].[Cs+].[Cs+]

InChI

InChI=1S/C17H10O9.4Cs/c18-13(7-1-3-9(14(19)20)11(5-7)16(23)24)8-2-4-10(15(21)22)12(6-8)17(25)26;;;;/h1-6H,(H,19,20)(H,21,22)(H,23,24)(H,25,26);;;;/q;4*+1/p-4