methyl N-(3-fluorophenyl)carbonyl-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate

Systemtic Name: methyl N-(3-fluorophenyl)carbonyl-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Openeye Name: 3-fluoro-N-[C-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]benzamide CAS Name: N-[(3-fluorophenyl)-oxomethyl]-N'-[2-(1-pyrrolidin-1-iumyl)ethyl]carbamimidic acid methyl ester IUPAC Name: methyl N-(3-fluorobenzoyl)-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Traditional Name: 3-fluoro-N-[C-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]benzamide Formula: C15H21FN3O2+ MolecularWeight: 294.344543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C15H20FN3O2/c1-21-15(17-7-10-19-8-2-3-9-19)18-14(20)12-5-4-6-13(16)11-12/h4-6,11H,2-3,7-10H2,1H3,(H,17,18,20)/p+1