[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(phenylmethyl)-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(phenylmethyl)-(pyridin-3-ylmethyl)azanium Openeye Name: benzyl-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-(3-pyridylmethyl)ammonium CAS Name: [(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl-(phenylmethyl)-(3-pyridinylmethyl)ammonium IUPAC Name: benzyl-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: benzyl-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-(3-pyridylmethyl)ammonium Formula: C25H37N3+2 MolecularWeight: 379.58138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)C[NH+](CC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)C[NH+](CC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C25H35N3/c1-3-9-22(10-4-1)18-27(19-23-11-7-15-26-17-23)20-24-12-8-16-28(21-24)25-13-5-2-6-14-25/h1,3-4,7,9-11,15,17,24-25H,2,5-6,8,12-14,16,18-21H2/p+2/t24-/m1/s1