(E)-4-[(3,5-dimethylphenyl)amino]-2-methyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3,5-dimethylphenyl)amino]-2-methyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(3,5-dimethylanilino)-2-methyl-4-oxo-but-2-enoic acid CAS Name: (E)-4-(3,5-dimethylanilino)-2-methyl-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(3,5-dimethylanilino)-2-methyl-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3,5-dimethylanilino)-4-keto-2-methyl-but-2-enoic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-8-4-9(2)6-11(5-8)14-12(15)7-10(3)13(16)17/h4-7H,1-3H3,(H,14,15)(H,16,17)/b10-7+