[3-[4-(4-methoxyphenyl)butylamino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[4-(4-methoxyphenyl)butylamino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[4-(4-methoxyphenyl)butylamino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[4-(4-methoxyphenyl)butylamino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[4-(4-methoxyphenyl)butylamino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[4-(4-methoxyphenyl)butylamino]-1-phosphono-propyl]phosphonic acid Formula: C14H25NO8P2 MolecularWeight: 397.297722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCNCCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCCCNCCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H25NO8P2/c1-23-13-7-5-12(6-8-13)4-2-3-10-15-11-9-14(16,24(17,18)19)25(20,21)22/h5-8,15-16H,2-4,9-11H2,1H3,(H2,17,18,19)(H2,20,21,22)