2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine

Systemtic Name: 2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Openeye Name: 2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine CAS Name: 2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-piperidin-1-iumyl]imidazo[4,5-b]pyridine IUPAC Name: 2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Traditional Name: 2-cyclohexyl-3-[1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium-4-yl]imidazo[4,5-b]pyridine Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC3=C(N2C4CC[NH+](CC4)CC5=CC6=C(C=C5)OCCO6)N=CC=C3

Isomeric SMILES

C1CCC(CC1)C2=NC3=C(N2C4CC[NH+](CC4)CC5=CC6=C(C=C5)OCCO6)N=CC=C3

InChI

InChI=1S/C26H32N4O2/c1-2-5-20(6-3-1)25-28-22-7-4-12-27-26(22)30(25)21-10-13-29(14-11-21)18-19-8-9-23-24(17-19)32-16-15-31-23/h4,7-9,12,17,20-21H,1-3,5-6,10-11,13-16,18H2/p+1