1,1'-biphenyl; oxaldehydoyl 2-oxidanylideneethanoate; dihydrate

Systemtic Name: 1,1'-biphenyl; oxaldehydoyl 2-oxidanylideneethanoate; dihydrate Openeye Name: biphenyl; oxaldehydoyl 2-oxoacetate; dihydrate CAS Name: 1,1'-biphenyl; 2-oxoacetic acid oxaldehydoyl ester; dihydrate IUPAC Name: 1,1'-biphenyl; oxaldehydoyl 2-oxoacetate; dihydrate Traditional Name: biphenyl; 2-ketoacetic acid glyoxyloyl ester; dihydrate Formula: C16H16O7 MolecularWeight: 320.29404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10.C4H2O5.2H2O/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;5-1-3(7)9-4(8)2-6;;/h1-10H;1-2H;2*1H2