2-[2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde

Systemtic Name: 2-[2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Openeye Name: 2-[2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde CAS Name: 2-[2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]ethoxy]benzaldehyde IUPAC Name: 2-[2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Traditional Name: 2-[2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCOC2=CC=CC=C2C=O)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCOC2=CC=CC=C2C=O)C

InChI

InChI=1S/C16H23NO2/c1-13-9-14(2)11-17(10-13)7-8-19-16-6-4-3-5-15(16)12-18/h3-6,12-14H,7-11H2,1-2H3/p+1/t13-,14-/m1/s1