cyclohexyl-[[2-(2-fluoranyl-5-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-prop-2-ynyl-azanium

Systemtic Name: cyclohexyl-[[2-(2-fluoranyl-5-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-prop-2-ynyl-azanium Openeye Name: cyclohexyl-[[2-(2-fluoro-5-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-prop-2-ynyl-ammonium CAS Name: cyclohexyl-[[2-(2-fluoro-5-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]-prop-2-ynylammonium IUPAC Name: cyclohexyl-[[2-(2-fluoro-5-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-prop-2-ynylazanium Traditional Name: cyclohexyl-[[2-(2-fluoro-5-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-propargyl-ammonium Formula: C21H26FN2O2+ MolecularWeight: 357.441743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=C(C=CC(=C2)OC)F)C[NH+](CC#C)C3CCCCC3

Isomeric SMILES

CC1=C(N=C(O1)C2=C(C=CC(=C2)OC)F)C[NH+](CC#C)C3CCCCC3

InChI

InChI=1S/C21H25FN2O2/c1-4-12-24(16-8-6-5-7-9-16)14-20-15(2)26-21(23-20)18-13-17(25-3)10-11-19(18)22/h1,10-11,13,16H,5-9,12,14H2,2-3H3/p+1