N-[3-(4-fluorophenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[3-(4-fluorophenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)isoxazole-3-carboxamide CAS Name: N-[3-(4-fluorophenyl)propyl]-5-(4-morpholin-4-iumylmethyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[3-(4-fluorophenyl)propyl]-5-(morpholin-4-ium-4-ylmethyl)isoxazole-3-carboxamide Formula: C18H23FN3O3+ MolecularWeight: 348.391923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC(=NO2)C(=O)NCCCC3=CC=C(C=C3)F

Isomeric SMILES

C1COCC[NH+]1CC2=CC(=NO2)C(=O)NCCCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3O3/c19-15-5-3-14(4-6-15)2-1-7-20-18(23)17-12-16(25-21-17)13-22-8-10-24-11-9-22/h3-6,12H,1-2,7-11,13H2,(H,20,23)/p+1