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

Systemtic Name: 3-cyclohexyl-1-[(3R)-3-[3-oxidanylidene-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]piperidin-1-yl]propan-1-one Openeye Name: 3-cyclohexyl-1-[(3R)-3-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]-1-piperidyl]propan-1-one CAS Name: 3-cyclohexyl-1-[(3R)-3-[3-oxo-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]propyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-cyclohexyl-1-[(3R)-3-[3-oxo-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propyl]piperidin-1-yl]propan-1-one Traditional Name: 3-cyclohexyl-1-[(3R)-3-[3-keto-3-(4-pyridin-1-ium-2-ylpiperazino)propyl]piperidino]propan-1-one Formula: C26H41N4O2+ MolecularWeight: 441.62934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N2CCCC(C2)CCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CCC(CC1)CCC(=O)N2CCC[C@@H](C2)CCC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C26H40N4O2/c31-25(29-19-17-28(18-20-29)24-10-4-5-15-27-24)14-12-23-9-6-16-30(21-23)26(32)13-11-22-7-2-1-3-8-22/h4-5,10,15,22-23H,1-3,6-9,11-14,16-21H2/p+1/t23-/m1/s1