2-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethanal hydrate

Systemtic Name: 2-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethanal hydrate Openeye Name: 2-(2-fluoro-4-methoxy-phenyl)-2-oxo-acetaldehyde hydrate CAS Name: 2-(2-fluoro-4-methoxyphenyl)-2-oxoacetaldehyde hydrate IUPAC Name: 2-(2-fluoro-4-methoxyphenyl)-2-oxoacetaldehyde hydrate Traditional Name: 2-(2-fluoro-4-methoxy-phenyl)-2-keto-acetaldehyde hydrate Formula: C9H9FO4 MolecularWeight: 200.163763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=O)F.O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C=O)F.O

InChI

InChI=1S/C9H7FO3.H2O/c1-13-6-2-3-7(8(10)4-6)9(12)5-11;/h2-5H,1H3;1H2