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

Systemtic Name: [3-[3-(4-methoxyphenoxy)propyl-methyl-amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[3-(4-methoxyphenoxy)propyl-methyl-amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[3-(4-methoxyphenoxy)propyl-methylamino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[3-(4-methoxyphenoxy)propyl-methylamino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[3-(4-methoxyphenoxy)propyl-methyl-amino]-1-phosphono-propyl]phosphonic acid Formula: C14H25NO9P2 MolecularWeight: 413.297122

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=CC=C(C=C1)OC)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCCOC1=CC=C(C=C1)OC)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H25NO9P2/c1-15(10-8-14(16,25(17,18)19)26(20,21)22)9-3-11-24-13-6-4-12(23-2)5-7-13/h4-7,16H,3,8-11H2,1-2H3,(H2,17,18,19)(H2,20,21,22)