2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethanal hydrate

Systemtic Name: 2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethanal hydrate Openeye Name: 2-(5-bromo-2-thienyl)-2-oxo-acetaldehyde hydrate CAS Name: 2-(5-bromo-2-thiophenyl)-2-oxoacetaldehyde hydrate IUPAC Name: 2-(5-bromothiophen-2-yl)-2-oxoacetaldehyde hydrate Traditional Name: 2-(5-bromo-2-thienyl)-2-keto-acetaldehyde hydrate Formula: C6H5BrO3S MolecularWeight: 237.0711

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C(=O)C=O.O

Isomeric SMILES

C1=C(SC(=C1)Br)C(=O)C=O.O

InChI

InChI=1S/C6H3BrO2S.H2O/c7-6-2-1-5(10-6)4(9)3-8;/h1-3H;1H2