2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 6-azanyl-2-(methylamino)hexanoic acid

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 6-azanyl-2-(methylamino)hexanoic acid Openeye Name: 2-amino-5-guanidino-pentanoic acid; 6-amino-2-(methylamino)hexanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 6-amino-2-(methylamino)hexanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 6-amino-2-(methylamino)hexanoic acid Traditional Name: 2-amino-5-guanidino-valeric acid; 6-amino-2-(methylamino)hexanoic acid Formula: C13H30N6O4 MolecularWeight: 334.4151

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CCCCN)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CNC(CCCCN)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C7H16N2O2.C6H14N4O2/c1-9-6(7(10)11)4-2-3-5-8;7-4(5(11)12)2-1-3-10-6(8)9/h6,9H,2-5,8H2,1H3,(H,10,11);4H,1-3,7H2,(H,11,12)(H4,8,9,10)