2-[2-azanylbutoxy(oxidanyl)phosphoryl]-4-phosphono-pentanedioic acid

Systemtic Name: 2-[2-azanylbutoxy(oxidanyl)phosphoryl]-4-phosphono-pentanedioic acid Openeye Name: 2-[2-aminobutoxy(hydroxy)phosphoryl]-4-phosphono-pentanedioic acid CAS Name: 2-[2-aminobutoxy(hydroxy)phosphoryl]-4-phosphonopentanedioic acid IUPAC Name: 2-[2-aminobutoxy(hydroxy)phosphoryl]-4-phosphonopentanedioic acid Traditional Name: 2-[2-aminobutoxy(hydroxy)phosphoryl]-4-phosphono-glutaric acid Formula: C9H19NO10P2 MolecularWeight: 363.195382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COP(=O)(C(CC(C(=O)O)P(=O)(O)O)C(=O)O)O)N

Isomeric SMILES

CCC(COP(=O)(C(CC(C(=O)O)P(=O)(O)O)C(=O)O)O)N

InChI

InChI=1S/C9H19NO10P2/c1-2-5(10)4-20-22(18,19)7(9(13)14)3-6(8(11)12)21(15,16)17/h5-7H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,18,19)(H2,15,16,17)