(E)-3-oxidanylidene-5-[2-(sulfinylmethyl)phenyl]pent-4-enoic acid

Systemtic Name: (E)-3-oxidanylidene-5-[2-(sulfinylmethyl)phenyl]pent-4-enoic acid Openeye Name: (E)-3-oxo-5-[2-(sulfinylmethyl)phenyl]pent-4-enoic acid CAS Name: (E)-3-oxo-5-[2-(sulfinylmethyl)phenyl]-4-pentenoic acid IUPAC Name: (E)-3-oxo-5-[2-(sulfinylmethyl)phenyl]pent-4-enoic acid Traditional Name: (E)-3-keto-5-[2-(sulfinylmethyl)phenyl]pent-4-enoic acid Formula: C12H10O4S MolecularWeight: 250.2704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10O4S/c13-11(7-12(14)15)6-5-9-3-1-2-4-10(9)8-17-16/h1-6,8H,7H2,(H,14,15)/b6-5+