[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-fluoranylbenzoate

Systemtic Name: [2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-fluoranylbenzoate Openeye Name: [2-(3-morpholinosulfonylanilino)-2-oxo-1-phenyl-ethyl] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [2-[3-(4-morpholinylsulfonyl)anilino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3-morpholin-4-ylsulfonylanilino)-2-oxo-1-phenylethyl] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [2-keto-2-(3-morpholinosulfonylanilino)-1-phenyl-ethyl] ester Formula: C25H23FN2O6S MolecularWeight: 498.523323

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)C(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)C(C3=CC=CC=C3)OC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H23FN2O6S/c26-22-12-5-4-11-21(22)25(30)34-23(18-7-2-1-3-8-18)24(29)27-19-9-6-10-20(17-19)35(31,32)28-13-15-33-16-14-28/h1-12,17,23H,13-16H2,(H,27,29)