(5-chloranyl-1-methyl-imidazol-2-yl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C16H17ClFN3O5S MolecularWeight: 417.839683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C16H17ClFN3O5S/c1-20-14(17)9-19-15(20)10-26-16(22)11-2-3-12(18)13(8-11)27(23,24)21-4-6-25-7-5-21/h2-3,8-9H,4-7,10H2,1H3