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

Systemtic Name: 2-methylpropyl N-(4-fluorophenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Openeye Name: 4-fluoro-N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]benzamide CAS Name: N-[(4-fluorophenyl)-oxomethyl]-N'-[3-(4-morpholin-4-iumyl)propyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-(4-fluorobenzoyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Traditional Name: 4-fluoro-N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]benzamide Formula: C19H29FN3O3+ MolecularWeight: 366.450263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28FN3O3/c1-15(2)14-26-19(21-8-3-9-23-10-12-25-13-11-23)22-18(24)16-4-6-17(20)7-5-16/h4-7,15H,3,8-14H2,1-2H3,(H,21,22,24)/p+1