2-(2-bromanyl-2-phosphono-ethyl)-2-phosphono-butanedioic acid

Systemtic Name: 2-(2-bromanyl-2-phosphono-ethyl)-2-phosphono-butanedioic acid Openeye Name: 2-(2-bromo-2-phosphono-ethyl)-2-phosphono-butanedioic acid CAS Name: 2-(2-bromo-2-phosphonoethyl)-2-phosphonobutanedioic acid IUPAC Name: 2-(2-bromo-2-phosphonoethyl)-2-phosphonobutanedioic acid Traditional Name: 2-(2-bromo-2-phosphono-ethyl)-2-phosphono-succinic acid Formula: C6H11BrO10P2 MolecularWeight: 384.997062

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Descriptors Computed from Structure

Canonical SMILES:

C(C(P(=O)(O)O)Br)C(CC(=O)O)(C(=O)O)P(=O)(O)O

Isomeric SMILES

C(C(P(=O)(O)O)Br)C(CC(=O)O)(C(=O)O)P(=O)(O)O

InChI

InChI=1S/C6H11BrO10P2/c7-3(18(12,13)14)1-6(5(10)11,2-4(8)9)19(15,16)17/h3H,1-2H2,(H,8,9)(H,10,11)(H2,12,13,14)(H2,15,16,17)