(E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]prop-2-enoic acid CAS Name: (E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-[4-methoxy-2-methyl-6-(trifluoromethyl)phenyl]acrylic acid Formula: C14H14F3NO4 MolecularWeight: 317.26047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C=C(C(=O)O)NC(=O)C)C(F)(F)F)OC

Isomeric SMILES

CC1=CC(=CC(=C1/C=C(\C(=O)O)/NC(=O)C)C(F)(F)F)OC

InChI

InChI=1S/C14H14F3NO4/c1-7-4-9(22-3)5-11(14(15,16)17)10(7)6-12(13(20)21)18-8(2)19/h4-6H,1-3H3,(H,18,19)(H,20,21)/b12-6+