4-[(E)-3-(4-fluoranyl-3-thiophen-2-yl-phenyl)prop-2-enoyl]benzoic acid

Systemtic Name: 4-[(E)-3-(4-fluoranyl-3-thiophen-2-yl-phenyl)prop-2-enoyl]benzoic acid Openeye Name: 4-[(E)-3-[4-fluoro-3-(2-thienyl)phenyl]prop-2-enoyl]benzoic acid CAS Name: 4-[(E)-3-(4-fluoro-3-thiophen-2-ylphenyl)-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(4-fluoro-3-thiophen-2-ylphenyl)prop-2-enoyl]benzoic acid Traditional Name: 4-[(E)-3-[4-fluoro-3-(2-thienyl)phenyl]acryloyl]benzoic acid Formula: C20H13FO3S MolecularWeight: 352.378823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13FO3S/c21-17-9-3-13(12-16(17)19-2-1-11-25-19)4-10-18(22)14-5-7-15(8-6-14)20(23)24/h1-12H,(H,23,24)/b10-4+