[3-[(4-methoxyphenoxy)-propyl-amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[(4-methoxyphenoxy)-propyl-amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[(4-methoxyphenoxy)-propyl-amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[(4-methoxyphenoxy)-propylamino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[(4-methoxyphenoxy)-propylamino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[(4-methoxyphenoxy)-propyl-amino]-1-phosphono-propyl]phosphonic acid Formula: C13H23NO9P2 MolecularWeight: 399.270542

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(O)(P(=O)(O)O)P(=O)(O)O)OC1=CC=C(C=C1)OC

Isomeric SMILES

CCCN(CCC(O)(P(=O)(O)O)P(=O)(O)O)OC1=CC=C(C=C1)OC

InChI

InChI=1S/C13H23NO9P2/c1-3-9-14(23-12-6-4-11(22-2)5-7-12)10-8-13(15,24(16,17)18)25(19,20)21/h4-7,15H,3,8-10H2,1-2H3,(H2,16,17,18)(H2,19,20,21)