1,2-diphenylethane-1,2-dione hydrate

Systemtic Name: 1,2-diphenylethane-1,2-dione hydrate Openeye Name: 1,2-diphenylethane-1,2-dione hydrate CAS Name: 1,2-diphenylethane-1,2-dione hydrate IUPAC Name: 1,2-diphenylethane-1,2-dione hydrate Traditional Name: benzil hydrate Formula: C28H22O5 MolecularWeight: 438.47128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C14H10O2.H2O/c2*15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12;/h2*1-10H;1H2