2-methoxy-N-[2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-methoxy-N-[2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-methoxy-N-[2-[1-[[(3R)-tetrahydrofuran-3-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-methoxy-N-[2-[1-[[(3R)-3-oxolanyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-methoxy-N-[2-[1-[[(3R)-oxolan-3-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-methoxy-N-[2-[1-[[(3R)-tetrahydrofuran-3-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4CCOC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)C[C@H]4CCOC4

InChI

InChI=1S/C21H28N4O3/c1-27-19-5-3-2-4-18(19)21(26)23-20-6-10-22-25(20)17-7-11-24(12-8-17)14-16-9-13-28-15-16/h2-6,10,16-17H,7-9,11-15H2,1H3,(H,23,26)/p+1/t16-/m1/s1