2-methylidene-4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-methylidene-4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-methylanilino)-2-methylene-4-oxo-butanoic acid CAS Name: 4-(4-methylanilino)-2-methylene-4-oxobutanoic acid IUPAC Name: 4-(4-methylanilino)-2-methylidene-4-oxobutanoic acid Traditional Name: 2-[2-keto-2-(p-toluidino)ethyl]acrylic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-8-3-5-10(6-4-8)13-11(14)7-9(2)12(15)16/h3-6H,2,7H2,1H3,(H,13,14)(H,15,16)