2-[[6-azanyl-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[6-azanyl-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[6-amino-2-(benzyloxycarbonylamino)hexanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[6-amino-1-oxo-2-(phenylmethoxycarbonylamino)hexyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[6-amino-2-(phenylmethoxycarbonylamino)hexanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[6-amino-2-(benzyloxycarbonylamino)hexanoyl]amino]-3-phenyl-propionic acid Formula: C23H29N3O5 MolecularWeight: 427.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CCCCN)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CCCCN)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O5/c24-14-8-7-13-19(26-23(30)31-16-18-11-5-2-6-12-18)21(27)25-20(22(28)29)15-17-9-3-1-4-10-17/h1-6,9-12,19-20H,7-8,13-16,24H2,(H,25,27)(H,26,30)(H,28,29)