[4-chloranyl-2-[1-(1H-imidazol-3-ium-2-ylmethyl)piperidin-4-yl]oxy-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-chloranyl-2-[1-(1H-imidazol-3-ium-2-ylmethyl)piperidin-4-yl]oxy-phenyl]-piperidin-1-yl-methanone Openeye Name: [4-chloro-2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidyl]oxy]phenyl]-(1-piperidyl)methanone CAS Name: [4-chloro-2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidinyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-chloro-2-[1-(1H-imidazol-3-ium-2-ylmethyl)piperidin-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-chloro-2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidyl]oxy]phenyl]-piperidino-methanone Formula: C21H28ClN4O2+ MolecularWeight: 403.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)OC3CCN(CC3)CC4=[NH+]C=CN4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)OC3CCN(CC3)CC4=[NH+]C=CN4

InChI

InChI=1S/C21H27ClN4O2/c22-16-4-5-18(21(27)26-10-2-1-3-11-26)19(14-16)28-17-6-12-25(13-7-17)15-20-23-8-9-24-20/h4-5,8-9,14,17H,1-3,6-7,10-13,15H2,(H,23,24)/p+1