6-[5-(cyclopropylcarbamoyl)-3-fluoranyl-2-methyl-phenyl]-1-oxidanidyl-N-propyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[5-(cyclopropylcarbamoyl)-3-fluoranyl-2-methyl-phenyl]-1-oxidanidyl-N-propyl-pyridin-1-ium-3-carboxamide Openeye Name: 6-[5-(cyclopropylcarbamoyl)-3-fluoro-2-methyl-phenyl]-1-oxido-N-propyl-pyridin-1-ium-3-carboxamide CAS Name: 6-[5-[(cyclopropylamino)-oxomethyl]-3-fluoro-2-methylphenyl]-1-oxido-N-propyl-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[5-(cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-1-oxido-N-propylpyridin-1-ium-3-carboxamide Traditional Name: 6-[5-(cyclopropylcarbamoyl)-3-fluoro-2-methyl-phenyl]-1-oxido-N-propyl-pyridin-1-ium-3-carboxamide Formula: C20H22FN3O3 MolecularWeight: 371.405383

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C[N+](=C(C=C1)C2=CC(=CC(=C2C)F)C(=O)NC3CC3)[O-]

Isomeric SMILES

CCCNC(=O)C1=C[N+](=C(C=C1)C2=CC(=CC(=C2C)F)C(=O)NC3CC3)[O-]

InChI

InChI=1S/C20H22FN3O3/c1-3-8-22-19(25)13-4-7-18(24(27)11-13)16-9-14(10-17(21)12(16)2)20(26)23-15-5-6-15/h4,7,9-11,15H,3,5-6,8H2,1-2H3,(H,22,25)(H,23,26)