methyl 2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanoate

Systemtic Name: methyl 2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanoate Openeye Name: methyl 2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetate CAS Name: 2-[(3R,5S)-3,5-dimethyl-1-piperidin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetate Traditional Name: 2-[(3R,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetic acid methyl ester Formula: C10H20NO2+ MolecularWeight: 186.2713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H19NO2/c1-8-4-9(2)6-11(5-8)7-10(12)13-3/h8-9H,4-7H2,1-3H3/p+1/t8-,9+