[[bis(diphosphonooxymethyl)amino]-phosphonooxy-methyl] dihydrogen phosphate

Systemtic Name: [[bis(diphosphonooxymethyl)amino]-phosphonooxy-methyl] dihydrogen phosphate Openeye Name: [[bis(diphosphonooxymethyl)amino]-phosphonooxy-methyl] dihydrogen phosphate CAS Name: [[bis(diphosphonooxymethyl)amino]-phosphonooxymethyl] dihydrogen phosphate IUPAC Name: [[bis(diphosphonooxymethyl)amino]-phosphonooxymethyl] dihydrogen phosphate Traditional Name: [[bis(diphosphonooxymethyl)amino]-phosphonooxy-methyl] dihydrogen phosphate Formula: C3H15NO24P6 MolecularWeight: 634.986066

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Descriptors Computed from Structure

Canonical SMILES:

C(N(C(OP(=O)(O)O)OP(=O)(O)O)C(OP(=O)(O)O)OP(=O)(O)O)(OP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

C(N(C(OP(=O)(O)O)OP(=O)(O)O)C(OP(=O)(O)O)OP(=O)(O)O)(OP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C3H15NO24P6/c5-29(6,7)23-1(24-30(8,9)10)4(2(25-31(11,12)13)26-32(14,15)16)3(27-33(17,18)19)28-34(20,21)22/h1-3H,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)