3-fluoranyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 3-fluoranyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Openeye Name: 3-fluoro-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide CAS Name: 3-fluoro-N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-fluoro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Traditional Name: 3-fluoro-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Formula: C19H24FN4O3+ MolecularWeight: 375.417263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN(CC(=O)NC2=NOC=C2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1CC[NH+](CC1)CCN(CC(=O)NC2=NOC=C2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H23FN4O3/c20-16-6-4-5-15(13-16)19(26)24(11-10-23-8-2-1-3-9-23)14-18(25)21-17-7-12-27-22-17/h4-7,12-13H,1-3,8-11,14H2,(H,21,22,25)/p+1