(3R,4R)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[(2-fluoranyl-5-methoxy-phenyl)methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(2-fluoro-5-methoxy-phenyl)methyl]-4-morpholino-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(2-fluoro-5-methoxyphenyl)methyl]-4-(4-morpholinyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(2-fluoro-5-methoxyphenyl)methyl]-4-morpholin-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-(2-fluoro-5-methoxy-benzyl)-4-morpholino-piperidin-1-ium-3-ol Formula: C17H26FN2O3+ MolecularWeight: 325.398343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)F)C[NH+]2CCC(C(C2)O)N3CCOCC3

Isomeric SMILES

COC1=CC(=C(C=C1)F)C[NH+]2CC[C@H]([C@@H](C2)O)N3CCOCC3

InChI

InChI=1S/C17H25FN2O3/c1-22-14-2-3-15(18)13(10-14)11-19-5-4-16(17(21)12-19)20-6-8-23-9-7-20/h2-3,10,16-17,21H,4-9,11-12H2,1H3/p+1/t16-,17-/m1/s1