N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-benzyloxypiperidin-1-ium-1-yl)-N-(2-cyclopentylpyrazol-3-yl)acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-(4-phenylmethoxy-1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(4-phenylmethoxypiperidin-1-ium-1-yl)acetamide Traditional Name: 2-(4-benzoxypiperidin-1-ium-1-yl)-N-(2-cyclopentylpyrazol-3-yl)acetamide Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H30N4O2/c27-22(24-21-10-13-23-26(21)19-8-4-5-9-19)16-25-14-11-20(12-15-25)28-17-18-6-2-1-3-7-18/h1-3,6-7,10,13,19-20H,4-5,8-9,11-12,14-17H2,(H,24,27)/p+1