[2-[ethyl(3-phenylpropyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [2-[ethyl(3-phenylpropyl)amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [2-[ethyl(3-phenylpropyl)amino]-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [2-[ethyl(3-phenylpropyl)amino]-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [2-[ethyl(3-phenylpropyl)amino]-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [2-[ethyl(3-phenylpropyl)amino]-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C14H25NO7P2 MolecularWeight: 381.298322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC1=CC=CC=C1)C(C)C(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCN(CCCC1=CC=CC=C1)C(C)C(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H25NO7P2/c1-3-15(11-7-10-13-8-5-4-6-9-13)12(2)14(16,23(17,18)19)24(20,21)22/h4-6,8-9,12,16H,3,7,10-11H2,1-2H3,(H2,17,18,19)(H2,20,21,22)