2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrazole-3-carboxamide

Systemtic Name: 2-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrazole-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-methyl-pyrazole-3-carboxamide CAS Name: 2-methyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-methylpyrazole-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-methyl-pyrazole-3-carboxamide Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=CC=N1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O/c1-20-16(7-10-18-20)17(22)19-15-8-11-21(12-9-15)13-14-5-3-2-4-6-14/h2-7,10,15H,8-9,11-13H2,1H3,(H,19,22)/p+1