4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-bromo-2,6-dimethyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(4-bromo-2,6-dimethylanilino)-4-oxobutanoic acid IUPAC Name: 4-(4-bromo-2,6-dimethylanilino)-4-oxobutanoic acid Traditional Name: 4-(4-bromo-2,6-dimethyl-anilino)-4-keto-butyric acid Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CCC(=O)O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CCC(=O)O)C)Br

InChI

InChI=1S/C12H14BrNO3/c1-7-5-9(13)6-8(2)12(7)14-10(15)3-4-11(16)17/h5-6H,3-4H2,1-2H3,(H,14,15)(H,16,17)