1-(1-ethylpyrazol-4-yl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(1-ethylpyrazol-4-yl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(1-ethylpyrazole-4-carbonyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[(1-ethyl-4-pyrazolyl)-oxomethyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(1-ethylpyrazole-4-carbonyl)-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-(1-ethylpyrazole-4-carbonyl)-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C17H28N5O2+ MolecularWeight: 334.43652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3

Isomeric SMILES

CCN1C=C(C=N1)C(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3

InChI

InChI=1S/C17H27N5O2/c1-2-22-13-14(12-19-22)15(23)20-10-6-17(7-11-20,16(18)24)21-8-4-3-5-9-21/h12-13H,2-11H2,1H3,(H2,18,24)/p+1