(E)-3-[(2-ethyl-6-methyl-phenyl)amino]prop-2-enoic acid

Systemtic Name: (E)-3-[(2-ethyl-6-methyl-phenyl)amino]prop-2-enoic acid Openeye Name: (E)-3-(2-ethyl-6-methyl-anilino)prop-2-enoic acid CAS Name: (E)-3-(2-ethyl-6-methylanilino)-2-propenoic acid IUPAC Name: (E)-3-(2-ethyl-6-methylanilino)prop-2-enoic acid Traditional Name: (E)-3-(2-ethyl-6-methyl-anilino)acrylic acid Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC=CC(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1N/C=C/C(=O)O)C

InChI

InChI=1S/C12H15NO2/c1-3-10-6-4-5-9(2)12(10)13-8-7-11(14)15/h4-8,13H,3H2,1-2H3,(H,14,15)/b8-7+