but-2-ynyl-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-(furan-2-ylmethyl)azanium

Systemtic Name: but-2-ynyl-[[2-(4-fluoranyl-3-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-(furan-2-ylmethyl)azanium Openeye Name: but-2-ynyl-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-(2-furylmethyl)ammonium CAS Name: but-2-ynyl-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]-(2-furanylmethyl)ammonium IUPAC Name: but-2-ynyl-[[2-(4-fluoro-3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-(furan-2-ylmethyl)azanium Traditional Name: but-2-ynyl-[[2-(4-fluoro-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-(2-furfuryl)ammonium Formula: C21H22FN2O3+ MolecularWeight: 369.409383

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC[NH+](CC1=CC=CO1)CC2=C(OC(=N2)C3=CC(=C(C=C3)F)OC)C

Isomeric SMILES

CC#CC[NH+](CC1=CC=CO1)CC2=C(OC(=N2)C3=CC(=C(C=C3)F)OC)C

InChI

InChI=1S/C21H21FN2O3/c1-4-5-10-24(13-17-7-6-11-26-17)14-19-15(2)27-21(23-19)16-8-9-18(22)20(12-16)25-3/h6-9,11-12H,10,13-14H2,1-3H3/p+1