[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium

Systemtic Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Openeye Name: [3-[(2-fluorophenyl)methyl]-2-isopropylsulfonyl-imidazol-4-yl]methyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-4-imidazolyl]methyl-methyl-(4-oxanyl)ammonium IUPAC Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonylimidazol-4-yl]methyl-methyl-(oxan-4-yl)azanium Traditional Name: [3-(2-fluorobenzyl)-2-isopropylsulfonyl-imidazol-4-yl]methyl-methyl-tetrahydropyran-4-yl-ammonium Formula: C20H29FN3O3S+ MolecularWeight: 410.525963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+](C)C3CCOCC3

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+](C)C3CCOCC3

InChI

InChI=1S/C20H28FN3O3S/c1-15(2)28(25,26)20-22-12-18(14-23(3)17-8-10-27-11-9-17)24(20)13-16-6-4-5-7-19(16)21/h4-7,12,15,17H,8-11,13-14H2,1-3H3/p+1