5-(furan-2-yl)-2-(3-methylphenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrazole-3-carboxamide

Systemtic Name: 5-(furan-2-yl)-2-(3-methylphenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrazole-3-carboxamide Openeye Name: 5-(2-furyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-2-(m-tolyl)pyrazole-3-carboxamide CAS Name: 5-(2-furanyl)-2-(3-methylphenyl)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-3-pyrazolecarboxamide IUPAC Name: 5-(furan-2-yl)-2-(3-methylphenyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]pyrazole-3-carboxamide Traditional Name: 5-(2-furyl)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-2-(m-tolyl)pyrazole-3-carboxamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=NN2C3=CC=CC(=C3)C)C4=CC=CO4

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=NN2C3=CC=CC(=C3)C)C4=CC=CO4

InChI

InChI=1S/C24H30N4O2/c1-18-8-5-10-20(16-18)28-22(17-21(26-28)23-11-6-15-30-23)24(29)25-12-7-14-27-13-4-3-9-19(27)2/h5-6,8,10-11,15-17,19H,3-4,7,9,12-14H2,1-2H3,(H,25,29)/p+1/t19-/m0/s1