[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(2,5-dichloroanilino)-2-oxo-ethyl] 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid [2-(2,5-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dichloroanilino)-2-oxoethyl] 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid [2-(2,5-dichloroanilino)-2-keto-ethyl] ester Formula: C19H17Cl2FN2O6S MolecularWeight: 491.317483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl)F

InChI

InChI=1S/C19H17Cl2FN2O6S/c20-13-2-3-14(21)16(10-13)23-18(25)11-30-19(26)12-1-4-15(22)17(9-12)31(27,28)24-5-7-29-8-6-24/h1-4,9-10H,5-8,11H2,(H,23,25)