3-cyclopentyl-1-[(3R)-3-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]piperidin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[(3R)-3-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]piperidin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[(3R)-3-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-1-piperidyl]propan-1-one CAS Name: 3-cyclopentyl-1-[(3R)-3-[3-oxo-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]propyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[(3R)-3-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]piperidin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[(3R)-3-[3-keto-3-(4-pyridin-1-ium-2-ylpiperazino)propyl]piperidino]propan-1-one Formula: C25H39N4O2+ MolecularWeight: 427.60276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCCC(C2)CCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCC[C@@H](C2)CCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C25H38N4O2/c30-24(28-18-16-27(17-19-28)23-9-3-4-14-26-23)13-11-22-8-5-15-29(20-22)25(31)12-10-21-6-1-2-7-21/h3-4,9,14,21-22H,1-2,5-8,10-13,15-20H2/p+1/t22-/m1/s1