2-[4-(dimethylamino)-2-methyl-phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[4-(dimethylamino)-2-methyl-phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 2-[4-(dimethylamino)-2-methyl-phenyl]-4-oxo-butanoic acid CAS Name: 2-[4-(dimethylamino)-2-methylphenyl]-4-oxobutanoic acid IUPAC Name: 2-[4-(dimethylamino)-2-methylphenyl]-4-oxobutanoic acid Traditional Name: 2-[4-(dimethylamino)-2-methyl-phenyl]-4-keto-butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-9-8-10(14(2)3)4-5-11(9)12(6-7-15)13(16)17/h4-5,7-8,12H,6H2,1-3H3,(H,16,17)