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

Systemtic Name: 2-chloranyl-N-[2-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-2-chloro-benzamide CAS Name: 2-chloro-N-[2-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-2-chlorobenzamide Traditional Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-2-chloro-benzamide Formula: C22H24ClN4O+ MolecularWeight: 395.90516

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O/c23-20-9-5-4-8-19(20)22(28)25-21-10-13-24-27(21)18-11-14-26(15-12-18)16-17-6-2-1-3-7-17/h1-10,13,18H,11-12,14-16H2,(H,25,28)/p+1