4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoate IUPAC Name: 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyrate Formula: C8H6ClO3S- MolecularWeight: 217.64944

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1=C(SC(=C1)Cl)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C8H7ClO3S/c9-7-3-2-6(13-7)5(10)1-4-8(11)12/h2-3H,1,4H2,(H,11,12)/p-1