methyl 2-azanyl-3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: methyl 2-azanyl-3-(3,5-dimethyl-4-oxidanyl-phenyl)propanoate Openeye Name: methyl 2-amino-3-(4-hydroxy-3,5-dimethyl-phenyl)propanoate CAS Name: 2-amino-3-(4-hydroxy-3,5-dimethylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-(4-hydroxy-3,5-dimethylphenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxy-3,5-dimethyl-phenyl)propionic acid methyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CC(C(=O)OC)N

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CC(C(=O)OC)N

InChI

InChI=1S/C12H17NO3/c1-7-4-9(5-8(2)11(7)14)6-10(13)12(15)16-3/h4-5,10,14H,6,13H2,1-3H3