[4-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[3-(1-pyrazolyl)propyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCCN4C=CC=N4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCCN4C=CC=N4

InChI

InChI=1S/C22H30N4O2/c27-22(25-13-1-2-14-25)19-5-7-20(8-6-19)28-21-9-17-24(18-10-21)12-4-16-26-15-3-11-23-26/h3,5-8,11,15,21H,1-2,4,9-10,12-14,16-18H2/p+1