1-(4-fluorophenyl)-3-(3-methoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-3-(3-methoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide Formula: C25H30FN4O2+ MolecularWeight: 437.529703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H29FN4O2/c1-17(2)29-13-11-20(12-14-29)27-25(31)23-16-30(21-9-7-19(26)8-10-21)28-24(23)18-5-4-6-22(15-18)32-3/h4-10,15-17,20H,11-14H2,1-3H3,(H,27,31)/p+1