methyl 2-azanyl-5-methyl-3-(2-oxidanylidenebutyl)benzoate

Systemtic Name: methyl 2-azanyl-5-methyl-3-(2-oxidanylidenebutyl)benzoate Openeye Name: methyl 2-amino-5-methyl-3-(2-oxobutyl)benzoate CAS Name: 2-amino-5-methyl-3-(2-oxobutyl)benzoic acid methyl ester IUPAC Name: methyl 2-amino-5-methyl-3-(2-oxobutyl)benzoate Traditional Name: 2-amino-3-(2-ketobutyl)-5-methyl-benzoic acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=C(C(=CC(=C1)C)C(=O)OC)N

Isomeric SMILES

CCC(=O)CC1=C(C(=CC(=C1)C)C(=O)OC)N

InChI

InChI=1S/C13H17NO3/c1-4-10(15)7-9-5-8(2)6-11(12(9)14)13(16)17-3/h5-6H,4,7,14H2,1-3H3