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

Systemtic Name: 4-[(2-bromanyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-bromo-4-methyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(2-bromo-4-methylanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-bromo-4-methylanilino)-4-oxobutanoic acid Traditional Name: 4-(2-bromo-4-methyl-anilino)-4-keto-butyric acid Formula: C11H12BrNO3 MolecularWeight: 286.12188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12BrNO3/c1-7-2-3-9(8(12)6-7)13-10(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H,15,16)