2-chloranyl-N-[2-(1-ethylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-(1-ethylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide Openeye Name: 2-chloro-N-[2-(1-ethylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[2-(1-ethyl-4-piperidin-1-iumyl)-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[2-(1-ethylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[2-(1-ethylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide Formula: C17H22ClN4O+ MolecularWeight: 333.83578

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H21ClN4O/c1-2-21-11-8-13(9-12-21)22-16(7-10-19-22)20-17(23)14-5-3-4-6-15(14)18/h3-7,10,13H,2,8-9,11-12H2,1H3,(H,20,23)/p+1