methyl (2S)-2-[2-(6-ethyl-1-benzofuran-3-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-(6-ethyl-1-benzofuran-3-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-(6-ethylbenzofuran-3-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-(6-ethyl-3-benzofuranyl)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(6-ethyl-1-benzofuran-3-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(6-ethylbenzofuran-3-yl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H23NO4/c1-3-15-9-10-18-17(14-27-20(18)12-15)13-21(24)23-19(22(25)26-2)11-16-7-5-4-6-8-16/h4-10,12,14,19H,3,11,13H2,1-2H3,(H,23,24)/t19-/m0/s1