[3-[methyl(7-phenylheptyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[methyl(7-phenylheptyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-[methyl(7-phenylheptyl)amino]-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-[methyl(7-phenylheptyl)amino]-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-[methyl(7-phenylheptyl)amino]-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-[methyl(7-phenylheptyl)amino]-1-phosphono-propyl]phosphonic acid Formula: C17H31NO7P2 MolecularWeight: 423.378062

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCCCC1=CC=CC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCCCCCCC1=CC=CC=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C17H31NO7P2/c1-18(15-13-17(19,26(20,21)22)27(23,24)25)14-9-4-2-3-6-10-16-11-7-5-8-12-16/h5,7-8,11-12,19H,2-4,6,9-10,13-15H2,1H3,(H2,20,21,22)(H2,23,24,25)