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

Systemtic Name: 2-[2-fluoranyl-4-[(E)-3-naphthalen-2-ylprop-2-enoyl]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-fluoro-4-[(E)-3-(2-naphthyl)prop-2-enoyl]phenyl]sulfanylacetic acid CAS Name: 2-[[2-fluoro-4-[(E)-3-(2-naphthalenyl)-1-oxoprop-2-enyl]phenyl]thio]acetic acid IUPAC Name: 2-[2-fluoro-4-[(E)-3-naphthalen-2-ylprop-2-enoyl]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-fluoro-4-[(E)-3-(2-naphthyl)acryloyl]phenyl]thio]acetic acid Formula: C21H15FO3S MolecularWeight: 366.405403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=CC(=O)C3=CC(=C(C=C3)SCC(=O)O)F

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)/C=C/C(=O)C3=CC(=C(C=C3)SCC(=O)O)F

InChI

InChI=1S/C21H15FO3S/c22-18-12-17(8-10-20(18)26-13-21(24)25)19(23)9-6-14-5-7-15-3-1-2-4-16(15)11-14/h1-12H,13H2,(H,24,25)/b9-6+