[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] 3-(styrylsulfonylamino)benzoate CAS Name: 3-(2-phenylethenylsulfonylamino)benzoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 3-(2-phenylethenylsulfonylamino)benzoate Traditional Name: 3-(styrylsulfonylamino)benzoic acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C24H21FN2O5S MolecularWeight: 468.497343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CS(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)C=CS(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H21FN2O5S/c25-21-11-9-19(10-12-21)16-26-23(28)17-32-24(29)20-7-4-8-22(15-20)27-33(30,31)14-13-18-5-2-1-3-6-18/h1-15,27H,16-17H2,(H,26,28)