sodium 2-(2-azanyl-4-bromanyl-5-methyl-phenyl)-2-oxidanylidene-ethanoate

Systemtic Name: sodium 2-(2-azanyl-4-bromanyl-5-methyl-phenyl)-2-oxidanylidene-ethanoate Openeye Name: sodium 2-(2-amino-4-bromo-5-methyl-phenyl)-2-oxo-acetate CAS Name: sodium 2-(2-amino-4-bromo-5-methylphenyl)-2-oxoacetate IUPAC Name: sodium 2-(2-amino-4-bromo-5-methylphenyl)-2-oxoacetate Traditional Name: sodium 2-(2-amino-4-bromo-5-methyl-phenyl)-2-keto-acetate Formula: C9H7BrNNaO3 MolecularWeight: 280.05055

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(=O)C(=O)[O-])N)Br.[Na+]

Isomeric SMILES

CC1=C(C=C(C(=C1)C(=O)C(=O)[O-])N)Br.[Na+]

InChI

InChI=1S/C9H8BrNO3.Na/c1-4-2-5(8(12)9(13)14)7(11)3-6(4)10;/h2-3H,11H2,1H3,(H,13,14);/q;+1/p-1