2-(1,1-diphosphonoethylamino)butanedioic acid

Systemtic Name: 2-(1,1-diphosphonoethylamino)butanedioic acid Openeye Name: 2-(1,1-diphosphonoethylamino)butanedioic acid CAS Name: 2-(1,1-diphosphonoethylamino)butanedioic acid IUPAC Name: 2-(1,1-diphosphonoethylamino)butanedioic acid Traditional Name: 2-(1,1-diphosphonoethylamino)succinic acid Formula: C6H13NO10P2 MolecularWeight: 321.115642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H13NO10P2/c1-6(18(12,13)14,19(15,16)17)7-3(5(10)11)2-4(8)9/h3,7H,2H2,1H3,(H,8,9)(H,10,11)(H2,12,13,14)(H2,15,16,17)