N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-1-phenyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazole-4-carboxamide CAS Name: N-[[1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl]-N-[[(2R)-2-oxolanyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-1-phenyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazole-4-carboxamide Formula: C24H35N4O3+ MolecularWeight: 427.5597

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCC(CC1)CN(CC2CCCO2)C(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COCC[NH+]1CCC(CC1)CN(C[C@H]2CCCO2)C(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H34N4O3/c1-30-15-13-26-11-9-20(10-12-26)17-27(19-23-8-5-14-31-23)24(29)21-16-25-28(18-21)22-6-3-2-4-7-22/h2-4,6-7,16,18,20,23H,5,8-15,17,19H2,1H3/p+1/t23-/m1/s1