3-[2-(5-azanylpentanoylamino)ethanoylamino]-2-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[2-(5-azanylpentanoylamino)ethanoylamino]-2-pyridin-3-yl-propanoic acid Openeye Name: 3-[[2-(5-aminopentanoylamino)acetyl]amino]-2-(3-pyridyl)propanoic acid CAS Name: 3-[[2-[(5-amino-1-oxopentyl)amino]-1-oxoethyl]amino]-2-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[2-(5-aminopentanoylamino)acetyl]amino]-2-pyridin-3-ylpropanoic acid Traditional Name: 3-[[2-(5-aminopentanoylamino)acetyl]amino]-2-(3-pyridyl)propionic acid Formula: C15H22N4O4 MolecularWeight: 322.35958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CNC(=O)CNC(=O)CCCCN)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C(CNC(=O)CNC(=O)CCCCN)C(=O)O

InChI

InChI=1S/C15H22N4O4/c16-6-2-1-5-13(20)19-10-14(21)18-9-12(15(22)23)11-4-3-7-17-8-11/h3-4,7-8,12H,1-2,5-6,9-10,16H2,(H,18,21)(H,19,20)(H,22,23)