(phenylmethyl) 2-[[2-oxidanylidene-1-(2-oxidanylidene-2-phenylmethoxy-ethyl)azepan-3-yl]amino]propanoate

Systemtic Name: (phenylmethyl) 2-[[2-oxidanylidene-1-(2-oxidanylidene-2-phenylmethoxy-ethyl)azepan-3-yl]amino]propanoate Openeye Name: benzyl 2-[[1-(2-benzyloxy-2-oxo-ethyl)-2-oxo-azepan-3-yl]amino]propanoate CAS Name: 2-[[2-oxo-1-(2-oxo-2-phenylmethoxyethyl)-3-azepanyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-oxo-1-(2-oxo-2-phenylmethoxyethyl)azepan-3-yl]amino]propanoate Traditional Name: 2-[[1-(2-benzoxy-2-keto-ethyl)-2-keto-azepan-3-yl]amino]propionic acid benzyl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC2CCCCN(C2=O)CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)NC2CCCCN(C2=O)CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O5/c1-19(25(30)32-18-21-12-6-3-7-13-21)26-22-14-8-9-15-27(24(22)29)16-23(28)31-17-20-10-4-2-5-11-20/h2-7,10-13,19,22,26H,8-9,14-18H2,1H3