2-(3-chlorophenyl)-5-(5-methylfuran-2-yl)-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-chlorophenyl)-5-(5-methylfuran-2-yl)-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 2-(3-chlorophenyl)-5-(5-methyl-2-furyl)-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide CAS Name: 2-(3-chlorophenyl)-5-(5-methyl-2-furanyl)-N-[2-(1-piperidin-1-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-chlorophenyl)-5-(5-methylfuran-2-yl)-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 2-(3-chlorophenyl)-5-(5-methyl-2-furyl)-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Formula: C22H26ClN4O2+ MolecularWeight: 413.92044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC[NH+]3CCCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)NCC[NH+]3CCCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O2/c1-16-8-9-21(29-16)19-15-20(27(25-19)18-7-5-6-17(23)14-18)22(28)24-10-13-26-11-3-2-4-12-26/h5-9,14-15H,2-4,10-13H2,1H3,(H,24,28)/p+1