methyl (2S)-3-(4-hydroxyphenyl)-2-[2-(2-phenylethanoylamino)ethanoylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[2-(2-phenylethanoylamino)ethanoylamino]propanoate Openeye Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[2-[(2-phenylacetyl)amino]acetyl]amino]propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[[1-oxo-2-[(1-oxo-2-phenylethyl)amino]ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-hydroxyphenyl)-2-[[2-[(2-phenylacetyl)amino]acetyl]amino]propanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[[2-[(2-phenylacetyl)amino]acetyl]amino]propionic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CNC(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)CNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-27-20(26)17(11-15-7-9-16(23)10-8-15)22-19(25)13-21-18(24)12-14-5-3-2-4-6-14/h2-10,17,23H,11-13H2,1H3,(H,21,24)(H,22,25)/t17-/m0/s1