[4-[bis(azanyl)methylideneamino]-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-[bis(azanyl)methylideneamino]-1-phosphono-butyl]phosphonic acid Openeye Name: (4-guanidino-1-phosphono-butyl)phosphonic acid CAS Name: [4-(diaminomethylideneamino)-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-(diaminomethylideneamino)-1-phosphonobutyl]phosphonic acid Traditional Name: (4-guanidino-1-phosphono-butyl)phosphonic acid Formula: C5H15N3O6P2 MolecularWeight: 275.136622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(P(=O)(O)O)P(=O)(O)O)CN=C(N)N

Isomeric SMILES

C(CC(P(=O)(O)O)P(=O)(O)O)CN=C(N)N

InChI

InChI=1S/C5H15N3O6P2/c6-5(7)8-3-1-2-4(15(9,10)11)16(12,13)14/h4H,1-3H2,(H4,6,7,8)(H2,9,10,11)(H2,12,13,14)