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

Systemtic Name: [1-oxidanyl-3-[3-phenoxypropyl(propyl)amino]-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[3-phenoxypropyl(propyl)amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[3-phenoxypropyl(propyl)amino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[3-phenoxypropyl(propyl)amino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[3-phenoxypropyl(propyl)amino]-1-phosphono-propyl]phosphonic acid Formula: C15H27NO8P2 MolecularWeight: 411.324302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCOC1=CC=CC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCN(CCCOC1=CC=CC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C15H27NO8P2/c1-2-10-16(11-6-13-24-14-7-4-3-5-8-14)12-9-15(17,25(18,19)20)26(21,22)23/h3-5,7-8,17H,2,6,9-13H2,1H3,(H2,18,19,20)(H2,21,22,23)