ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C15H26N3O2+ MolecularWeight: 280.38584

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+]2CCC(CC2)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+]2CCC(CC2)C(=O)OCC

InChI

InChI=1S/C15H25N3O2/c1-4-18-11-14(12(3)16-18)10-17-8-6-13(7-9-17)15(19)20-5-2/h11,13H,4-10H2,1-3H3/p+1