(3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(1-methyl-2-benzimidazolyl)methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[(1-methylbenzimidazol-2-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Formula: C18H28N4O2+2 MolecularWeight: 332.44052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C18H26N4O2/c1-20-15-5-3-2-4-14(15)19-18(20)13-21-7-6-16(17(23)12-21)22-8-10-24-11-9-22/h2-5,16-17,23H,6-13H2,1H3/p+2/t16-,17-/m1/s1