ethyl 1-[(1R,3S)-3-methylcyclohexyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(1R,3S)-3-methylcyclohexyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(1R,3S)-3-methylcyclohexyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(1R,3S)-3-methylcyclohexyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1R,3S)-3-methylcyclohexyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(1R,3S)-3-methylcyclohexyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C15H28NO2+ MolecularWeight: 254.38832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)C2CCCC(C2)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)[C@@H]2CCC[C@@H](C2)C

InChI

InChI=1S/C15H27NO2/c1-3-18-15(17)13-7-9-16(10-8-13)14-6-4-5-12(2)11-14/h12-14H,3-11H2,1-2H3/p+1/t12-,14+/m0/s1