ethyl N-(4-fluorophenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate

Systemtic Name: ethyl N-(4-fluorophenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Openeye Name: N-[C-ethoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]-4-fluoro-benzamide CAS Name: N-[(4-fluorophenyl)-oxomethyl]-N'-[3-(4-morpholin-4-iumyl)propyl]carbamimidic acid ethyl ester IUPAC Name: ethyl N-(4-fluorobenzoyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Traditional Name: N-[C-ethoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]-4-fluoro-benzamide Formula: C17H25FN3O3+ MolecularWeight: 338.397103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3O3/c1-2-24-17(19-8-3-9-21-10-12-23-13-11-21)20-16(22)14-4-6-15(18)7-5-14/h4-7H,2-3,8-13H2,1H3,(H,19,20,22)/p+1