(E)-3-oxidanylidene-5-[4-(sulfonylmethyl)phenyl]pent-4-enoic acid

Systemtic Name: (E)-3-oxidanylidene-5-[4-(sulfonylmethyl)phenyl]pent-4-enoic acid Openeye Name: (E)-3-oxo-5-[4-(sulfonylmethyl)phenyl]pent-4-enoic acid CAS Name: (E)-3-oxo-5-[4-(sulfonylmethyl)phenyl]-4-pentenoic acid IUPAC Name: (E)-3-oxo-5-[4-(sulfonylmethyl)phenyl]pent-4-enoic acid Traditional Name: (E)-3-keto-5-[4-(sulfonylmethyl)phenyl]pent-4-enoic acid Formula: C12H10O5S MolecularWeight: 266.2698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)CC(=O)O)C=S(=O)=O

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)CC(=O)O)C=S(=O)=O

InChI

InChI=1S/C12H10O5S/c13-11(7-12(14)15)6-5-9-1-3-10(4-2-9)8-18(16)17/h1-6,8H,7H2,(H,14,15)/b6-5+