2-[3,5-bis(phenylmethoxy)phenyl]-2-oxidanylidene-ethanal hydrate

Systemtic Name: 2-[3,5-bis(phenylmethoxy)phenyl]-2-oxidanylidene-ethanal hydrate Openeye Name: 2-(3,5-dibenzyloxyphenyl)-2-oxo-acetaldehyde hydrate CAS Name: 2-[3,5-bis(phenylmethoxy)phenyl]-2-oxoacetaldehyde hydrate IUPAC Name: 2-[3,5-bis(phenylmethoxy)phenyl]-2-oxoacetaldehyde hydrate Traditional Name: 2-(3,5-dibenzoxyphenyl)-2-keto-acetaldehyde hydrate Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)C=O)OCC3=CC=CC=C3.O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)C=O)OCC3=CC=CC=C3.O

InChI

InChI=1S/C22H18O4.H2O/c23-14-22(24)19-11-20(25-15-17-7-3-1-4-8-17)13-21(12-19)26-16-18-9-5-2-6-10-18;/h1-14H,15-16H2;1H2