2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2-(dodecanoylamino)propanoic acid

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2-(dodecanoylamino)propanoic acid Openeye Name: 2-amino-5-guanidino-pentanoic acid; 2-(dodecanoylamino)propanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-(1-oxododecylamino)propanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-(dodecanoylamino)propanoic acid Traditional Name: 2-amino-5-guanidino-valeric acid; 2-(lauroylamino)propionic acid Formula: C21H43N5O5 MolecularWeight: 445.59662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(C)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C15H29NO3.C6H14N4O2/c1-3-4-5-6-7-8-9-10-11-12-14(17)16-13(2)15(18)19;7-4(5(11)12)2-1-3-10-6(8)9/h13H,3-12H2,1-2H3,(H,16,17)(H,18,19);4H,1-3,7H2,(H,11,12)(H4,8,9,10)