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

Systemtic Name: (E)-4-[methyl-(3-methylphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(N,3-dimethylanilino)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(N,3-dimethylanilino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(N,3-dimethylanilino)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(N,3-dimethylanilino)-4-keto-but-2-enoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=CC=C1)N(C)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H13NO3/c1-9-4-3-5-10(8-9)13(2)11(14)6-7-12(15)16/h3-8H,1-2H3,(H,15,16)/b7-6+