[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3,4-dimethyl-5-sulfamoyl-benzoate CAS Name: 3,4-dimethyl-5-sulfamoylbenzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3,4-dimethyl-5-sulfamoylbenzoate Traditional Name: 3,4-dimethyl-5-sulfamoyl-benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OCC(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)N)C

InChI

InChI=1S/C18H19FN2O5S/c1-11-7-14(8-16(12(11)2)27(20,24)25)18(23)26-10-17(22)21-9-13-3-5-15(19)6-4-13/h3-8H,9-10H2,1-2H3,(H,21,22)(H2,20,24,25)