(Z)-2-ethoxycarbonyl-3-[[2-(trifluoromethyl)phenyl]amino]hex-2-enoic acid

Systemtic Name: (Z)-2-ethoxycarbonyl-3-[[2-(trifluoromethyl)phenyl]amino]hex-2-enoic acid Openeye Name: (Z)-2-ethoxycarbonyl-3-[2-(trifluoromethyl)anilino]hex-2-enoic acid CAS Name: (Z)-2-ethoxycarbonyl-3-[2-(trifluoromethyl)anilino]-2-hexenoic acid IUPAC Name: (Z)-2-ethoxycarbonyl-3-[2-(trifluoromethyl)anilino]hex-2-enoic acid Traditional Name: (Z)-2-carbethoxy-3-[2-(trifluoromethyl)anilino]hex-2-enoic acid Formula: C16H18F3NO4 MolecularWeight: 345.31363

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(C(=O)O)C(=O)OCC)NC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCC/C(=C(\C(=O)O)/C(=O)OCC)/NC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C16H18F3NO4/c1-3-7-12(13(14(21)22)15(23)24-4-2)20-11-9-6-5-8-10(11)16(17,18)19/h5-6,8-9,20H,3-4,7H2,1-2H3,(H,21,22)/b13-12-