methyl 4-[(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoate Openeye Name: methyl 4-[(4-fluoro-3-morpholinosulfonyl-phenyl)sulfamoyl]benzoate CAS Name: 4-[[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-fluoro-3-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoate Traditional Name: 4-[(4-fluoro-3-morpholinosulfonyl-phenyl)sulfamoyl]benzoic acid methyl ester Formula: C18H19FN2O7S2 MolecularWeight: 458.481063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H19FN2O7S2/c1-27-18(22)13-2-5-15(6-3-13)29(23,24)20-14-4-7-16(19)17(12-14)30(25,26)21-8-10-28-11-9-21/h2-7,12,20H,8-11H2,1H3