N-[2-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propanamide Openeye Name: N-[2-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propanamide CAS Name: N-[2-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethylpropanamide Traditional Name: N-[2-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propionamide Formula: C20H28ClN4O+ MolecularWeight: 375.91552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H27ClN4O/c1-20(2,3)19(26)23-18-8-11-22-25(18)17-9-12-24(13-10-17)14-15-4-6-16(21)7-5-15/h4-8,11,17H,9-10,12-14H2,1-3H3,(H,23,26)/p+1