methyl 4-(4-hydroxyphenyl)-3-[(phenylmethyl)amino]butanoate

Systemtic Name: methyl 4-(4-hydroxyphenyl)-3-[(phenylmethyl)amino]butanoate Openeye Name: methyl 3-(benzylamino)-4-(4-hydroxyphenyl)butanoate CAS Name: 4-(4-hydroxyphenyl)-3-[(phenylmethyl)amino]butanoic acid methyl ester IUPAC Name: methyl 3-(benzylamino)-4-(4-hydroxyphenyl)butanoate Traditional Name: 3-(benzylamino)-4-(4-hydroxyphenyl)butyric acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC1=CC=C(C=C1)O)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(CC1=CC=C(C=C1)O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3/c1-22-18(21)12-16(11-14-7-9-17(20)10-8-14)19-13-15-5-3-2-4-6-15/h2-10,16,19-20H,11-13H2,1H3