2-(4-bromophenyl)-2-oxidanylidene-ethanal hydrate

Systemtic Name: 2-(4-bromophenyl)-2-oxidanylidene-ethanal hydrate Openeye Name: 2-(4-bromophenyl)-2-oxo-acetaldehyde hydrate CAS Name: 2-(4-bromophenyl)-2-oxoacetaldehyde hydrate IUPAC Name: 2-(4-bromophenyl)-2-oxoacetaldehyde hydrate Traditional Name: 2-(4-bromophenyl)-2-keto-acetaldehyde hydrate Formula: C8H7BrO3 MolecularWeight: 231.04338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=O)Br.O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C=O)Br.O

InChI

InChI=1S/C8H5BrO2.H2O/c9-7-3-1-6(2-4-7)8(11)5-10;/h1-5H;1H2