ethyl (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-3-(2-methoxyethyl)-1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C19H34N3O3+ MolecularWeight: 352.49156

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+]2CCCC(C2)(CCOC)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+]2CCC[C@](C2)(CCOC)C(=O)OCC)C

InChI

InChI=1S/C19H33N3O3/c1-5-10-22-16(3)17(13-20-22)14-21-11-7-8-19(15-21,9-12-24-4)18(23)25-6-2/h13H,5-12,14-15H2,1-4H3/p+1/t19-/m1/s1