2-[2,6-bis(azanyl)hexanoyl-phenylmethoxycarbonyl-amino]propanoic acid

Systemtic Name: 2-[2,6-bis(azanyl)hexanoyl-phenylmethoxycarbonyl-amino]propanoic acid Openeye Name: 2-[benzyloxycarbonyl(2,6-diaminohexanoyl)amino]propanoic acid CAS Name: 2-[(2,6-diamino-1-oxohexyl)-phenylmethoxycarbonylamino]propanoic acid IUPAC Name: 2-[2,6-diaminohexanoyl(phenylmethoxycarbonyl)amino]propanoic acid Traditional Name: 2-[carbobenzoxy(2,6-diaminohexanoyl)amino]propionic acid Formula: C17H25N3O5 MolecularWeight: 351.3975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C(=O)C(CCCCN)N)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)O)N(C(=O)C(CCCCN)N)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H25N3O5/c1-12(16(22)23)20(15(21)14(19)9-5-6-10-18)17(24)25-11-13-7-3-2-4-8-13/h2-4,7-8,12,14H,5-6,9-11,18-19H2,1H3,(H,22,23)