4-[(4-bromanyl-3-methyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[(4-bromanyl-3-methyl-phenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(4-bromo-3-methyl-anilino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(4-bromo-3-methylanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(4-bromo-3-methylanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(4-bromo-3-methyl-anilino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C15H20BrNO3 MolecularWeight: 342.2282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO3/c1-9(2)15(4,14(19)20)8-13(18)17-11-5-6-12(16)10(3)7-11/h5-7,9H,8H2,1-4H3,(H,17,18)(H,19,20)