5-(aminomethyl)-2-azanyl-6-[4-(nitrosomethylamino)pyridin-3-yl]-6-oxidanylidene-hexanoic acid

Systemtic Name: 5-(aminomethyl)-2-azanyl-6-[4-(nitrosomethylamino)pyridin-3-yl]-6-oxidanylidene-hexanoic acid Openeye Name: 2-amino-5-(aminomethyl)-6-[4-(nitrosomethylamino)-3-pyridyl]-6-oxo-hexanoic acid CAS Name: 2-amino-5-(aminomethyl)-6-[4-(nitrosomethylamino)-3-pyridinyl]-6-oxohexanoic acid IUPAC Name: 2-amino-5-(aminomethyl)-6-[4-(nitrosomethylamino)pyridin-3-yl]-6-oxohexanoic acid Traditional Name: 2-amino-5-(aminomethyl)-6-keto-6-[4-(nitrosomethylamino)-3-pyridyl]hexanoic acid Formula: C13H19N5O4 MolecularWeight: 309.32106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC(=C1NCN=O)C(=O)C(CCC(C(=O)O)N)CN

Isomeric SMILES

C1=CN=CC(=C1NCN=O)C(=O)C(CCC(C(=O)O)N)CN

InChI

InChI=1S/C13H19N5O4/c14-5-8(1-2-10(15)13(20)21)12(19)9-6-16-4-3-11(9)17-7-18-22/h3-4,6,8,10H,1-2,5,7,14-15H2,(H,16,17)(H,20,21)