1,1'-biphenyl; 5-phenylbenzene-1,2,3,4-tetracarboxylic acid; hydrate

Systemtic Name: 1,1'-biphenyl; 5-phenylbenzene-1,2,3,4-tetracarboxylic acid; hydrate Openeye Name: biphenyl; 5-phenylbenzene-1,2,3,4-tetracarboxylic acid; hydrate CAS Name: 1,1'-biphenyl; 5-phenylbenzene-1,2,3,4-tetracarboxylic acid; hydrate IUPAC Name: 1,1'-biphenyl; 5-phenylbenzene-1,2,3,4-tetracarboxylic acid; hydrate Traditional Name: biphenyl; 5-phenylmellophanic acid; hydrate Formula: C28H22O9 MolecularWeight: 502.46888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC(=C(C(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O.O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC(=C(C(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O.O

InChI

InChI=1S/C16H10O8.C12H10.H2O/c17-13(18)9-6-8(7-4-2-1-3-5-7)10(14(19)20)12(16(23)24)11(9)15(21)22;1-3-7-11(8-4-1)12-9-5-2-6-10-12;/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24);1-10H;1H2