1-[4-[1-[2-(2-hydroxyethyl)pyrimidin-4-yl]-4-piperidin-4-yl-piperidin-1-ium-1-yl]pyrimidin-2-yl]ethanol

Systemtic Name: 1-[4-[1-[2-(2-hydroxyethyl)pyrimidin-4-yl]-4-piperidin-4-yl-piperidin-1-ium-1-yl]pyrimidin-2-yl]ethanol Openeye Name: 1-[4-[1-[2-(2-hydroxyethyl)pyrimidin-4-yl]-4-(4-piperidyl)piperidin-1-ium-1-yl]pyrimidin-2-yl]ethanol CAS Name: 1-[4-[1-[2-(2-hydroxyethyl)-4-pyrimidinyl]-4-(4-piperidinyl)-1-piperidin-1-iumyl]-2-pyrimidinyl]ethanol IUPAC Name: 1-[4-[1-[2-(2-hydroxyethyl)pyrimidin-4-yl]-4-piperidin-4-ylpiperidin-1-ium-1-yl]pyrimidin-2-yl]ethanol Traditional Name: 1-[4-[1-[2-(2-hydroxyethyl)pyrimidin-4-yl]-4-(4-piperidyl)piperidin-1-ium-1-yl]pyrimidin-2-yl]ethanol Formula: C22H33N6O2+ MolecularWeight: 413.53642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CC(=N1)[N+]2(CCC(CC2)C3CCNCC3)C4=NC(=NC=C4)CCO)O

Isomeric SMILES

CC(C1=NC=CC(=N1)[N+]2(CCC(CC2)C3CCNCC3)C4=NC(=NC=C4)CCO)O

InChI

InChI=1S/C22H33N6O2/c1-16(30)22-25-12-5-21(27-22)28(20-4-11-24-19(26-20)8-15-29)13-6-18(7-14-28)17-2-9-23-10-3-17/h4-5,11-12,16-18,23,29-30H,2-3,6-10,13-15H2,1H3/q+1