[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H14ClFN2O5S MolecularWeight: 400.809163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl)F

InChI

InChI=1S/C16H14ClFN2O5S/c17-14-6-5-12(26(19,23)24)7-13(14)16(22)25-9-15(21)20-8-10-1-3-11(18)4-2-10/h1-7H,8-9H2,(H,20,21)(H2,19,23,24)