azane; [2-methylpentoxy(oxidanyl)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid

Systemtic Name: azane; [2-methylpentoxy(oxidanyl)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid Openeye Name: ammonia; [hydroxy(2-methylpentoxy)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid CAS Name: ammonia; [hydroxy(2-methylpentoxy)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid IUPAC Name: azane; [hydroxy(2-methylpentoxy)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid Traditional Name: ammonia; [hydroxy(2-methylpentoxy)phosphoryl]methylphosphonic acid; phosphonomethylphosphonic acid Formula: C10H42N2O24P8 MolecularWeight: 822.229568

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COP(=O)(CP(=O)(O)O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.N.N

Isomeric SMILES

CCCC(C)COP(=O)(CP(=O)(O)O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.N.N

InChI

InChI=1S/C7H18O6P2.3CH6O6P2.2H3N/c1-3-4-7(2)5-13-15(11,12)6-14(8,9)10;3*2-8(3,4)1-9(5,6)7;;/h7H,3-6H2,1-2H3,(H,11,12)(H2,8,9,10);3*1H2,(H2,2,3,4)(H2,5,6,7);2*1H3