(Z)-4-[(2,6-dimethylphenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[(2,6-dimethylphenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-(2,6-dimethylanilino)-4-oxo-but-2-enoic acid CAS Name: (Z)-4-(2,6-dimethylanilino)-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-(2,6-dimethylanilino)-4-oxobut-2-enoic acid Traditional Name: (Z)-4-(2,6-dimethylanilino)-4-keto-but-2-enoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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