cyclohexanamine; 2,2-dimethoxy-3-phosphonooxy-propanoic acid

Systemtic Name: cyclohexanamine; 2,2-dimethoxy-3-phosphonooxy-propanoic acid Openeye Name: cyclohexanamine; 2,2-dimethoxy-3-phosphonooxy-propanoic acid CAS Name: cyclohexanamine; 2,2-dimethoxy-3-phosphonooxypropanoic acid IUPAC Name: cyclohexanamine; 2,2-dimethoxy-3-phosphonooxypropanoic acid Traditional Name: cyclohexylamine; 2,2-dimethoxy-3-phosphonooxy-propionic acid Formula: C23H50N3O8P MolecularWeight: 527.632161

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Descriptors Computed from Structure

Canonical SMILES:

COC(COP(=O)(O)O)(C(=O)O)OC.C1CCC(CC1)N.C1CCC(CC1)N.C1CCC(CC1)N

Isomeric SMILES

COC(COP(=O)(O)O)(C(=O)O)OC.C1CCC(CC1)N.C1CCC(CC1)N.C1CCC(CC1)N

InChI

InChI=1S/3C6H13N.C5H11O8P/c3*7-6-4-2-1-3-5-6;1-11-5(12-2,4(6)7)3-13-14(8,9)10/h3*6H,1-5,7H2;3H2,1-2H3,(H,6,7)(H2,8,9,10)