(2S)-N'-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-N-[(4-methoxyphenyl)methyl]-2-oxidanyl-butanediamide

Systemtic Name: (2S)-N'-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-N-[(4-methoxyphenyl)methyl]-2-oxidanyl-butanediamide Openeye Name: (2S)-N'-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-2-hydroxy-N-[(4-methoxyphenyl)methyl]butanediamide CAS Name: (2S)-N'-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-hydroxy-N-[(4-methoxyphenyl)methyl]butanediamide IUPAC Name: (2S)-N'-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-hydroxy-N-[(4-methoxyphenyl)methyl]butanediamide Traditional Name: (2S)-N'-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-2-hydroxy-N-p-anisyl-succinamide Formula: C21H25N3O5 MolecularWeight: 399.4403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CC(=O)NC(CC2=CC=CC=C2)C(=O)N)O

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O5/c1-29-16-9-7-15(8-10-16)13-23-21(28)18(25)12-19(26)24-17(20(22)27)11-14-5-3-2-4-6-14/h2-10,17-18,25H,11-13H2,1H3,(H2,22,27)(H,23,28)(H,24,26)/t17-,18-/m0/s1