[[butyl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[butyl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [[butyl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid CAS Name: [[butyl(diphosphonomethyl)amino]-phosphonomethyl]phosphonic acid IUPAC Name: [[butyl(diphosphonomethyl)amino]-phosphonomethyl]phosphonic acid Traditional Name: [[butyl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid Formula: C6H19NO12P4 MolecularWeight: 421.109604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H19NO12P4/c1-2-3-4-7(5(20(8,9)10)21(11,12)13)6(22(14,15)16)23(17,18)19/h5-6H,2-4H2,1H3,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)