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[2,2-bis(azanyl)-1,8,8-triphosphono-octyl]phosphonic acid

[2,2-bis(azanyl)-1,8,8-triphosphono-octyl]phosphonic acid

Systemtic Name:[2,2-bis(azanyl)-1,8,8-triphosphono-octyl]phosphonic acid
Openeye Name:(2,2-diamino-1,8,8-triphosphono-octyl)phosphonic acid
CAS Name:(2,2-diamino-1,8,8-triphosphonooctyl)phosphonic acid
IUPAC Name:(2,2-diamino-1,8,8-triphosphonooctyl)phosphonic acid
Traditional Name:(2,2-diamino-1,8,8-triphosphono-octyl)phosphonic acid
Formula: C8H24N2O12P4
MolecularWeight: 464.177404
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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(P(=O)(O)O)P(=O)(O)O)CCC(C(P(=O)(O)O)P(=O)(O)O)(N)N


Isomeric SMILES

C(CCC(P(=O)(O)O)P(=O)(O)O)CCC(C(P(=O)(O)O)P(=O)(O)O)(N)N


InChI

InChI=1S/C8H24N2O12P4/c9-8(10,7(25(17,18)19)26(20,21)22)5-3-1-2-4-6(23(11,12)13)24(14,15)16/h6-7H,1-5,9-10H2,(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)


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