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

Systemtic Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-propyl-(pyridin-3-ylmethyl)azanium Openeye Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-propyl-(3-pyridylmethyl)ammonium CAS Name: [(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl-propyl-(3-pyridinylmethyl)ammonium IUPAC Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-propyl-(pyridin-3-ylmethyl)azanium Traditional Name: [(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-propyl-(3-pyridylmethyl)ammonium Formula: C21H37N3+2 MolecularWeight: 331.53858

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1CCC[NH+](C1)C2CCCCC2)CC3=CN=CC=C3

Isomeric SMILES

CCC[NH+](C[C@H]1CCC[NH+](C1)C2CCCCC2)CC3=CN=CC=C3

InChI

InChI=1S/C21H35N3/c1-2-13-23(16-19-8-6-12-22-15-19)17-20-9-7-14-24(18-20)21-10-4-3-5-11-21/h6,8,12,15,20-21H,2-5,7,9-11,13-14,16-18H2,1H3/p+2/t20-/m1/s1