2-(1,1-diphosphonoethylamino)-3-methyl-butanedioic acid

Systemtic Name: 2-(1,1-diphosphonoethylamino)-3-methyl-butanedioic acid Openeye Name: 2-(1,1-diphosphonoethylamino)-3-methyl-butanedioic acid CAS Name: 2-(1,1-diphosphonoethylamino)-3-methylbutanedioic acid IUPAC Name: 2-(1,1-diphosphonoethylamino)-3-methylbutanedioic acid Traditional Name: 2-(1,1-diphosphonoethylamino)-3-methyl-succinic acid Formula: C7H15NO10P2 MolecularWeight: 335.142222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(C)(P(=O)(O)O)P(=O)(O)O)C(=O)O

Isomeric SMILES

CC(C(C(=O)O)NC(C)(P(=O)(O)O)P(=O)(O)O)C(=O)O

InChI

InChI=1S/C7H15NO10P2/c1-3(5(9)10)4(6(11)12)8-7(2,19(13,14)15)20(16,17)18/h3-4,8H,1-2H3,(H,9,10)(H,11,12)(H2,13,14,15)(H2,16,17,18)