2-[2-fluoranyl-4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-fluoranyl-4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-fluoro-4-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl]sulfanylacetic acid CAS Name: 2-[[2-fluoro-4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl]thio]acetic acid IUPAC Name: 2-[2-fluoro-4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-fluoro-4-[(E)-3-(2-thienyl)acryloyl]phenyl]thio]acetic acid Formula: C15H11FO3S2 MolecularWeight: 322.374443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)C2=CC(=C(C=C2)SCC(=O)O)F

Isomeric SMILES

C1=CSC(=C1)/C=C/C(=O)C2=CC(=C(C=C2)SCC(=O)O)F

InChI

InChI=1S/C15H11FO3S2/c16-12-8-10(3-6-14(12)21-9-15(18)19)13(17)5-4-11-2-1-7-20-11/h1-8H,9H2,(H,18,19)/b5-4+