(E)-6-(5-chloranyl-2-oxidanyl-phenyl)-4-oxidanylidene-hex-5-enoic acid

Systemtic Name: (E)-6-(5-chloranyl-2-oxidanyl-phenyl)-4-oxidanylidene-hex-5-enoic acid Openeye Name: (E)-6-(5-chloro-2-hydroxy-phenyl)-4-oxo-hex-5-enoic acid CAS Name: (E)-6-(5-chloro-2-hydroxyphenyl)-4-oxo-5-hexenoic acid IUPAC Name: (E)-6-(5-chloro-2-hydroxyphenyl)-4-oxohex-5-enoic acid Traditional Name: (E)-6-(5-chloro-2-hydroxy-phenyl)-4-keto-hex-5-enoic acid Formula: C12H11ClO4 MolecularWeight: 254.66634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C=CC(=O)CCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)/C=C/C(=O)CCC(=O)O)O

InChI

InChI=1S/C12H11ClO4/c13-9-2-5-11(15)8(7-9)1-3-10(14)4-6-12(16)17/h1-3,5,7,15H,4,6H2,(H,16,17)/b3-1+