methyl 2-[(2-azanyl-3-methyl-butanoyl)amino]-5-fluoranyl-benzoate

Systemtic Name: methyl 2-[(2-azanyl-3-methyl-butanoyl)amino]-5-fluoranyl-benzoate Openeye Name: methyl 2-[(2-amino-3-methyl-butanoyl)amino]-5-fluoro-benzoate CAS Name: 2-[(2-amino-3-methyl-1-oxobutyl)amino]-5-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-[(2-amino-3-methylbutanoyl)amino]-5-fluorobenzoate Traditional Name: 2-[(2-amino-3-methyl-butanoyl)amino]-5-fluoro-benzoic acid methyl ester Formula: C13H17FN2O3 MolecularWeight: 268.284083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=C(C=C1)F)C(=O)OC)N

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=C(C=C1)F)C(=O)OC)N

InChI

InChI=1S/C13H17FN2O3/c1-7(2)11(15)12(17)16-10-5-4-8(14)6-9(10)13(18)19-3/h4-7,11H,15H2,1-3H3,(H,16,17)