ethyl (2R,4R)-4-methylpiperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R,4R)-4-methylpiperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R,4R)-4-methylpiperidin-1-ium-2-carboxylate CAS Name: (2R,4R)-4-methyl-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R,4R)-4-methylpiperidin-1-ium-2-carboxylate Traditional Name: (2R,4R)-4-methylpiperidin-1-ium-2-carboxylic acid ethyl ester Formula: C9H18NO2+ MolecularWeight: 172.24472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CC[NH2+]1)C

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H](CC[NH2+]1)C

InChI

InChI=1S/C9H17NO2/c1-3-12-9(11)8-6-7(2)4-5-10-8/h7-8,10H,3-6H2,1-2H3/p+1/t7-,8-/m1/s1