cyclohexane-1,2-diamine; phosphonomethylphosphonic acid

Systemtic Name: cyclohexane-1,2-diamine; phosphonomethylphosphonic acid Openeye Name: cyclohexane-1,2-diamine; phosphonomethylphosphonic acid CAS Name: cyclohexane-1,2-diamine; phosphonomethylphosphonic acid IUPAC Name: cyclohexane-1,2-diamine; phosphonomethylphosphonic acid Traditional Name: (2-aminocyclohexyl)amine; phosphonomethylphosphonic acid Formula: C10H38N2O24P8 MolecularWeight: 818.197808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N.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.C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CCC(C(C1)N)N.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.C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H14N2.4CH6O6P2/c7-5-3-1-2-4-6(5)8;4*2-8(3,4)1-9(5,6)7/h5-6H,1-4,7-8H2;4*1H2,(H2,2,3,4)(H2,5,6,7)