(E)-3-oxidanylidene-8-(3-thiophen-3-ylphenyl)oct-7-enoic acid

Systemtic Name: (E)-3-oxidanylidene-8-(3-thiophen-3-ylphenyl)oct-7-enoic acid Openeye Name: (E)-3-oxo-8-[3-(3-thienyl)phenyl]oct-7-enoic acid CAS Name: (E)-3-oxo-8-[3-(3-thiophenyl)phenyl]-7-octenoic acid IUPAC Name: (E)-3-oxo-8-(3-thiophen-3-ylphenyl)oct-7-enoic acid Traditional Name: (E)-3-keto-8-[3-(3-thienyl)phenyl]oct-7-enoic acid Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=CCCCC(=O)CC(=O)O)C2=CSC=C2

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/CCCC(=O)CC(=O)O)C2=CSC=C2

InChI

InChI=1S/C18H18O3S/c19-17(12-18(20)21)8-3-1-2-5-14-6-4-7-15(11-14)16-9-10-22-13-16/h2,4-7,9-11,13H,1,3,8,12H2,(H,20,21)/b5-2+