(3-azanyl-1-phosphono-butyl)phosphonic acid

Systemtic Name: (3-azanyl-1-phosphono-butyl)phosphonic acid Openeye Name: (3-amino-1-phosphono-butyl)phosphonic acid CAS Name: (3-amino-1-phosphonobutyl)phosphonic acid IUPAC Name: (3-amino-1-phosphonobutyl)phosphonic acid Traditional Name: (3-amino-1-phosphono-butyl)phosphonic acid Formula: C4H13NO6P2 MolecularWeight: 233.096642

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(P(=O)(O)O)P(=O)(O)O)N

Isomeric SMILES

CC(CC(P(=O)(O)O)P(=O)(O)O)N

InChI

InChI=1S/C4H13NO6P2/c1-3(5)2-4(12(6,7)8)13(9,10)11/h3-4H,2,5H2,1H3,(H2,6,7,8)(H2,9,10,11)