[[1-azanylpropan-2-yl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[1-azanylpropan-2-yl(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [[(2-amino-1-methyl-ethyl)-(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid CAS Name: [[1-aminopropan-2-yl(diphosphonomethyl)amino]-phosphonomethyl]phosphonic acid IUPAC Name: [[1-aminopropan-2-yl(diphosphonomethyl)amino]-phosphonomethyl]phosphonic acid Traditional Name: [[(2-amino-1-methyl-ethyl)-(diphosphonomethyl)amino]-phosphono-methyl]phosphonic acid Formula: C5H18N2O12P4 MolecularWeight: 422.097664

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)N(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(CN)N(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H18N2O12P4/c1-3(2-6)7(4(20(8,9)10)21(11,12)13)5(22(14,15)16)23(17,18)19/h3-5H,2,6H2,1H3,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)