3-methyl-2-[(4-methylphenyl)amino]but-3-enoic acid

Systemtic Name: 3-methyl-2-[(4-methylphenyl)amino]but-3-enoic acid Openeye Name: 3-methyl-2-(4-methylanilino)but-3-enoic acid CAS Name: 3-methyl-2-(4-methylanilino)-3-butenoic acid IUPAC Name: 3-methyl-2-(4-methylanilino)but-3-enoic acid Traditional Name: 3-methyl-2-(p-toluidino)but-3-enoic acid Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(C(=C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(C(=C)C)C(=O)O

InChI

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