N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=NN1C)C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C16H22N4O2/c1-12-10-13(18-19(12)2)16(21)17-11-14(15-6-5-9-22-15)20-7-3-4-8-20/h5-6,9-10,14H,3-4,7-8,11H2,1-2H3,(H,17,21)/p+1/t14-/m0/s1