[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-[(6-methyl-2-pyridyl)methyl]-(3-pyridylmethyl)ammonium CAS Name: [(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl-[(6-methyl-2-pyridinyl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-[(6-methylpyridin-2-yl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-[(6-methyl-2-pyridyl)methyl]-(3-pyridylmethyl)ammonium Formula: C25H38N4+2 MolecularWeight: 394.59602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+](CC2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+](C[C@H]2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C25H36N4/c1-21-8-5-11-24(27-21)20-28(17-22-9-6-14-26-16-22)18-23-10-7-15-29(19-23)25-12-3-2-4-13-25/h5-6,8-9,11,14,16,23,25H,2-4,7,10,12-13,15,17-20H2,1H3/p+2/t23-/m1/s1