3-[(2-bromanyl-3-methyl-butanoyl)amino]benzoic acid

Systemtic Name: 3-[(2-bromanyl-3-methyl-butanoyl)amino]benzoic acid Openeye Name: 3-[(2-bromo-3-methyl-butanoyl)amino]benzoic acid CAS Name: 3-[(2-bromo-3-methyl-1-oxobutyl)amino]benzoic acid IUPAC Name: 3-[(2-bromo-3-methylbutanoyl)amino]benzoic acid Traditional Name: 3-[(2-bromo-3-methyl-butanoyl)amino]benzoic acid Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)Br

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)Br

InChI

InChI=1S/C12H14BrNO3/c1-7(2)10(13)11(15)14-9-5-3-4-8(6-9)12(16)17/h3-7,10H,1-2H3,(H,14,15)(H,16,17)