1-[4-[[(3R,4R)-3-oxidanyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one

Systemtic Name: 1-[4-[[(3R,4R)-3-oxidanyl-4-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one Openeye Name: 1-[4-[[(3R,4R)-3-hydroxy-4-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one CAS Name: 1-[4-[[(3R,4R)-3-hydroxy-4-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]-1-piperidin-1-iumyl]methyl]phenyl]-2-imidazolidinone IUPAC Name: 1-[4-[[(3R,4R)-3-hydroxy-4-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenyl]imidazolidin-2-one Traditional Name: 1-[4-[[(3R,4R)-3-hydroxy-4-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)piperidin-1-ium-1-yl]methyl]phenyl]-2-imidazolidinone Formula: C24H35N6O2+3 MolecularWeight: 439.5737

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(C1[NH+]2CCN(CC2)C3=CC=CC=[NH+]3)O)CC4=CC=C(C=C4)N5CCNC5=O

Isomeric SMILES

C1C[NH+](C[C@H]([C@@H]1[NH+]2CCN(CC2)C3=CC=CC=[NH+]3)O)CC4=CC=C(C=C4)N5CCNC5=O

InChI

InChI=1S/C24H32N6O2/c31-22-18-27(17-19-4-6-20(7-5-19)30-12-10-26-24(30)32)11-8-21(22)28-13-15-29(16-14-28)23-3-1-2-9-25-23/h1-7,9,21-22,31H,8,10-18H2,(H,26,32)/p+3/t21-,22-/m1/s1