ethyl 2-(aminomethyl)-3-(4-ethylphenyl)propanoate

Systemtic Name: ethyl 2-(aminomethyl)-3-(4-ethylphenyl)propanoate Openeye Name: ethyl 2-(aminomethyl)-3-(4-ethylphenyl)propanoate CAS Name: 2-(aminomethyl)-3-(4-ethylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(aminomethyl)-3-(4-ethylphenyl)propanoate Traditional Name: 2-(aminomethyl)-3-(4-ethylphenyl)propionic acid ethyl ester Formula: C14H21NO2 MolecularWeight: 235.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(CN)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)CC(CN)C(=O)OCC

InChI

InChI=1S/C14H21NO2/c1-3-11-5-7-12(8-6-11)9-13(10-15)14(16)17-4-2/h5-8,13H,3-4,9-10,15H2,1-2H3