3-[(2-bromanyl-4-methyl-phenyl)amino]-2-methyl-propanoic acid

Systemtic Name: 3-[(2-bromanyl-4-methyl-phenyl)amino]-2-methyl-propanoic acid Openeye Name: 3-(2-bromo-4-methyl-anilino)-2-methyl-propanoic acid CAS Name: 3-(2-bromo-4-methylanilino)-2-methylpropanoic acid IUPAC Name: 3-(2-bromo-4-methylanilino)-2-methylpropanoic acid Traditional Name: 3-(2-bromo-4-methyl-anilino)-2-methyl-propionic acid Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NCC(C)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NCC(C)C(=O)O)Br

InChI

InChI=1S/C11H14BrNO2/c1-7-3-4-10(9(12)5-7)13-6-8(2)11(14)15/h3-5,8,13H,6H2,1-2H3,(H,14,15)