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

Systemtic Name: [2-[1-(1H-imidazol-3-ium-2-ylmethyl)piperidin-4-yl]oxyphenyl]-piperidin-1-yl-methanone Openeye Name: [2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidyl]oxy]phenyl]-(1-piperidyl)methanone CAS Name: [2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidinyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-[1-(1H-imidazol-3-ium-2-ylmethyl)piperidin-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [2-[[1-(1H-imidazol-3-ium-2-ylmethyl)-4-piperidyl]oxy]phenyl]-piperidino-methanone Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=CC=C2OC3CCN(CC3)CC4=[NH+]C=CN4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC=C2OC3CCN(CC3)CC4=[NH+]C=CN4

InChI

InChI=1S/C21H28N4O2/c26-21(25-12-4-1-5-13-25)18-6-2-3-7-19(18)27-17-8-14-24(15-9-17)16-20-22-10-11-23-20/h2-3,6-7,10-11,17H,1,4-5,8-9,12-16H2,(H,22,23)/p+1