methyl (2S)-2-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[3-(3,5-dimethoxyphenyl)-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[3-(3,5-dimethoxyphenyl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)NC(CC2=CC=CC=C2)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC)OC

InChI

InChI=1S/C21H25NO5/c1-25-17-11-16(12-18(14-17)26-2)9-10-20(23)22-19(21(24)27-3)13-15-7-5-4-6-8-15/h4-8,11-12,14,19H,9-10,13H2,1-3H3,(H,22,23)/t19-/m0/s1