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

Systemtic Name: 2-methylpropyl N-(2-fluorophenyl)carbonyl-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Openeye Name: 2-fluoro-N-[C-isobutoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]benzamide CAS Name: N-[(2-fluorophenyl)-oxomethyl]-N'-[2-(1-pyrrolidin-1-iumyl)ethyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-(2-fluorobenzoyl)-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Traditional Name: 2-fluoro-N-[C-isobutoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]benzamide Formula: C18H27FN3O2+ MolecularWeight: 336.424283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)COC(=NCC[NH+]1CCCC1)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C18H26FN3O2/c1-14(2)13-24-18(20-9-12-22-10-5-6-11-22)21-17(23)15-7-3-4-8-16(15)19/h3-4,7-8,14H,5-6,9-13H2,1-2H3,(H,20,21,23)/p+1