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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=NC=CN4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=NC=CN4

InChI

InChI=1S/C21H28N4O2/c26-21(25-12-2-1-3-13-25)17-4-6-18(7-5-17)27-19-8-14-24(15-9-19)16-20-22-10-11-23-20/h4-7,10-11,19H,1-3,8-9,12-16H2,(H,22,23)/p+1