(E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)-2-thienyl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[4-phenyl-5-(trifluoromethyl)-2-thienyl]acrylic acid Formula: C21H14F3NO3S MolecularWeight: 417.40097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=C2)C=C(C(=O)O)NC(=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(=C2)/C=C(\C(=O)O)/NC(=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H14F3NO3S/c22-21(23,24)18-16(13-7-3-1-4-8-13)11-15(29-18)12-17(20(27)28)25-19(26)14-9-5-2-6-10-14/h1-12H,(H,25,26)(H,27,28)/b17-12+