2-[[2-oxidanylidene-1-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)azepan-3-yl]amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[[2-oxidanylidene-1-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)azepan-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[1-(1-benzyl-2-hydroxy-2-oxo-ethyl)-2-oxo-azepan-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[1-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)-2-oxo-3-azepanyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[1-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)-2-oxoazepan-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[1-(1-benzyl-2-hydroxy-2-keto-ethyl)-2-keto-azepan-3-yl]amino]-4-phenyl-butyric acid Formula: C25H30N2O5 MolecularWeight: 438.5161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)NC(CCC2=CC=CC=C2)C(=O)O)C(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCN(C(=O)C(C1)NC(CCC2=CC=CC=C2)C(=O)O)C(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H30N2O5/c28-23-20(26-21(24(29)30)15-14-18-9-3-1-4-10-18)13-7-8-16-27(23)22(25(31)32)17-19-11-5-2-6-12-19/h1-6,9-12,20-22,26H,7-8,13-17H2,(H,29,30)(H,31,32)