(E)-4-(5-chloranylthiophen-2-yl)-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-(5-chloranylthiophen-2-yl)-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-(5-chloro-2-thienyl)-2-oxo-but-3-enoic acid CAS Name: (E)-4-(5-chloro-2-thiophenyl)-2-oxo-3-butenoic acid IUPAC Name: (E)-4-(5-chlorothiophen-2-yl)-2-oxobut-3-enoic acid Traditional Name: (E)-4-(5-chloro-2-thienyl)-2-keto-but-3-enoic acid Formula: C8H5ClO3S MolecularWeight: 216.6415

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)C=CC(=O)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)Cl)/C=C/C(=O)C(=O)O

InChI

InChI=1S/C8H5ClO3S/c9-7-4-2-5(13-7)1-3-6(10)8(11)12/h1-4H,(H,11,12)/b3-1+