[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)-prop-2-enyl-azanium

Systemtic Name: [1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)-prop-2-enyl-azanium Openeye Name: allyl-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [1-[(2-fluorophenyl)methyl]-2-pyrrolyl]methyl-[2-(4-morpholin-4-iumyl)ethyl]-prop-2-enylammonium IUPAC Name: [1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)-prop-2-enylazanium Traditional Name: allyl-[[1-(2-fluorobenzyl)pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H30FN3O+2 MolecularWeight: 359.480803

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC[NH+]1CCOCC1)CC2=CC=CN2CC3=CC=CC=C3F

Isomeric SMILES

C=CC[NH+](CC[NH+]1CCOCC1)CC2=CC=CN2CC3=CC=CC=C3F

InChI

InChI=1S/C21H28FN3O/c1-2-9-24(12-11-23-13-15-26-16-14-23)18-20-7-5-10-25(20)17-19-6-3-4-8-21(19)22/h2-8,10H,1,9,11-18H2/p+2