[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(oxan-4-yl)-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(oxan-4-yl)-(pyridin-3-ylmethyl)azanium Openeye Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(3-pyridylmethyl)-tetrahydropyran-4-yl-ammonium CAS Name: [(3S)-1-cyclohexyl-3-piperidin-1-iumyl]methyl-(4-oxanyl)-(3-pyridinylmethyl)ammonium IUPAC Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(oxan-4-yl)-(pyridin-3-ylmethyl)azanium Traditional Name: [(3S)-1-cyclohexylpiperidin-1-ium-3-yl]methyl-(3-pyridylmethyl)-tetrahydropyran-4-yl-ammonium Formula: C23H39N3O+2 MolecularWeight: 373.57526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)C[NH+](CC3=CN=CC=C3)C4CCOCC4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)C[NH+](CC3=CN=CC=C3)C4CCOCC4

InChI

InChI=1S/C23H37N3O/c1-2-8-22(9-3-1)25-13-5-7-21(18-25)19-26(23-10-14-27-15-11-23)17-20-6-4-12-24-16-20/h4,6,12,16,21-23H,1-3,5,7-11,13-15,17-19H2/p+2/t21-/m0/s1