3-[(3R)-1-imidazo[1,2-a]pyridin-2-ylcarbonylpiperidin-3-yl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(3R)-1-imidazo[1,2-a]pyridin-2-ylcarbonylpiperidin-3-yl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(3R)-1-(imidazo[1,2-a]pyridine-2-carbonyl)-3-piperidyl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-[(3R)-1-[2-imidazo[1,2-a]pyridinyl(oxo)methyl]-3-piperidinyl]-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(3R)-1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(3R)-1-(imidazo[1,2-a]pyridine-2-carbonyl)-3-piperidyl]-1-(4-pyridin-1-ium-2-ylpiperazino)propan-1-one Formula: C25H31N6O2+ MolecularWeight: 447.55264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CN3C=CC=CC3=N2)CCC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CN3C=CC=CC3=N2)CCC(=O)N4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C25H30N6O2/c32-24(29-16-14-28(15-17-29)22-7-1-3-11-26-22)10-9-20-6-5-13-31(18-20)25(33)21-19-30-12-4-2-8-23(30)27-21/h1-4,7-8,11-12,19-20H,5-6,9-10,13-18H2/p+1/t20-/m1/s1