4-[(5-bromanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-bromanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-bromo-2-methyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(5-bromo-2-methylanilino)-4-oxobutanoic acid IUPAC Name: 4-(5-bromo-2-methylanilino)-4-oxobutanoic acid Traditional Name: 4-(5-bromo-2-methyl-anilino)-4-keto-butyric acid Formula: C11H12BrNO3 MolecularWeight: 286.12188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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