2-[2-fluoranyl-4-[(E)-3-(4-phenylphenyl)prop-2-enoyl]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-fluoranyl-4-[(E)-3-(4-phenylphenyl)prop-2-enoyl]phenyl]sulfanylethanoic acid Openeye Name: 2-[2-fluoro-4-[(E)-3-(4-phenylphenyl)prop-2-enoyl]phenyl]sulfanylacetic acid CAS Name: 2-[[2-fluoro-4-[(E)-1-oxo-3-(4-phenylphenyl)prop-2-enyl]phenyl]thio]acetic acid IUPAC Name: 2-[2-fluoro-4-[(E)-3-(4-phenylphenyl)prop-2-enoyl]phenyl]sulfanylacetic acid Traditional Name: 2-[[2-fluoro-4-[(E)-3-(4-phenylphenyl)acryloyl]phenyl]thio]acetic acid Formula: C23H17FO3S MolecularWeight: 392.442683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C=CC(=O)C3=CC(=C(C=C3)SCC(=O)O)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C(=O)C3=CC(=C(C=C3)SCC(=O)O)F

InChI

InChI=1S/C23H17FO3S/c24-20-14-19(11-13-22(20)28-15-23(26)27)21(25)12-8-16-6-9-18(10-7-16)17-4-2-1-3-5-17/h1-14H,15H2,(H,26,27)/b12-8+