N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1-methyl-pyrazole-4-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-1-methylpyrazole-4-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1-methyl-pyrazole-4-carboxamide Formula: C15H21N4O2+ MolecularWeight: 289.35284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

CN1C=C(C=N1)C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C15H20N4O2/c1-18-11-12(9-17-18)15(20)16-10-13(14-5-4-8-21-14)19-6-2-3-7-19/h4-5,8-9,11,13H,2-3,6-7,10H2,1H3,(H,16,20)/p+1/t13-/m0/s1