N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,5-dimethyl-pyrazine-2-carboxamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,5-dimethyl-pyrazine-2-carboxamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,5-dimethyl-pyrazine-2-carboxamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-N,5-dimethyl-2-pyrazinecarboxamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,5-dimethylpyrazine-2-carboxamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-N,5-dimethyl-pyrazinamide Formula: C19H24FN4O+ MolecularWeight: 343.418463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(C)C2CCC[NH+](C2)CC3=CC=CC=C3F

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(C)[C@H]2CCC[NH+](C2)CC3=CC=CC=C3F

InChI

InChI=1S/C19H23FN4O/c1-14-10-22-18(11-21-14)19(25)23(2)16-7-5-9-24(13-16)12-15-6-3-4-8-17(15)20/h3-4,6,8,10-11,16H,5,7,9,12-13H2,1-2H3/p+1/t16-/m0/s1