(2R)-2-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]hexanal

Systemtic Name: (2R)-2-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]hexanal Openeye Name: (2R)-2-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]hexanal CAS Name: (2R)-2-ethyl-2-[(4-methyl-1-piperidin-1-iumyl)methyl]hexanal IUPAC Name: (2R)-2-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]hexanal Traditional Name: (2R)-2-ethyl-2-[(4-methylpiperidin-1-ium-1-yl)methyl]hexanal Formula: C15H30NO+ MolecularWeight: 240.4048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(C[NH+]1CCC(CC1)C)C=O

Isomeric SMILES

CCCC[C@](CC)(C[NH+]1CCC(CC1)C)C=O

InChI

InChI=1S/C15H29NO/c1-4-6-9-15(5-2,13-17)12-16-10-7-14(3)8-11-16/h13-14H,4-12H2,1-3H3/p+1/t15-/m1/s1