N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2,5-dimethyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2,5-dimethyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazole-3-carboxamide Openeye Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2,5-dimethyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazole-3-carboxamide CAS Name: N-[(1-cyclopentyl-4-piperidin-1-iumyl)methyl]-2,5-dimethyl-N-[[(2R)-2-oxolanyl]methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2,5-dimethyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazole-3-carboxamide Traditional Name: N-[(1-cyclopentylpiperidin-1-ium-4-yl)methyl]-2,5-dimethyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazole-3-carboxamide Formula: C22H37N4O2+ MolecularWeight: 389.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N(CC2CC[NH+](CC2)C3CCCC3)CC4CCCO4)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N(C[C@H]2CCCO2)CC3CC[NH+](CC3)C4CCCC4)C

InChI

InChI=1S/C22H36N4O2/c1-17-14-21(24(2)23-17)22(27)26(16-20-8-5-13-28-20)15-18-9-11-25(12-10-18)19-6-3-4-7-19/h14,18-20H,3-13,15-16H2,1-2H3/p+1/t20-/m1/s1