3-[(3R)-1-[(2-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(3R)-1-[(2-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(3R)-1-[(2-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(3R)-1-[(2-chlorophenyl)methyl]-3-piperidin-1-iumyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(3R)-1-[(2-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(3R)-1-(2-chlorobenzyl)piperidin-1-ium-3-yl]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C24H32ClN4O+ MolecularWeight: 427.99008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2Cl)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2Cl)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H31ClN4O/c25-22-8-2-1-7-21(22)19-27-13-5-6-20(18-27)10-11-24(30)29-16-14-28(15-17-29)23-9-3-4-12-26-23/h1-4,7-9,12,20H,5-6,10-11,13-19H2/p+1/t20-/m1/s1