ethyl 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-[(1S)-3,3-dimethylcyclohexyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H36NO3+ MolecularWeight: 326.49404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)C2CCCC(C2)(C)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)[C@H]2CCCC(C2)(C)C)CCOC

InChI

InChI=1S/C19H35NO3/c1-5-23-17(21)19(11-14-22-4)9-12-20(13-10-19)16-7-6-8-18(2,3)15-16/h16H,5-15H2,1-4H3/p+1/t16-/m0/s1