[4-chloranyl-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-chloranyl-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-piperidin-1-yl-methanone Openeye Name: [4-chloro-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-(1-piperidyl)methanone CAS Name: [4-chloro-2-[[1-[3-(1-pyrazolyl)propyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-piperidinyl)methanone IUPAC Name: [4-chloro-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxyphenyl]-piperidin-1-ylmethanone Traditional Name: [4-chloro-2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]oxy-phenyl]-piperidino-methanone Formula: C23H32ClN4O2+ MolecularWeight: 431.97878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)OC3CC[NH+](CC3)CCCN4C=CC=N4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)OC3CC[NH+](CC3)CCCN4C=CC=N4

InChI

InChI=1S/C23H31ClN4O2/c24-19-6-7-21(23(29)27-12-2-1-3-13-27)22(18-19)30-20-8-16-26(17-9-20)11-5-15-28-14-4-10-25-28/h4,6-7,10,14,18,20H,1-3,5,8-9,11-13,15-17H2/p+1