[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-oxo-2-ureido-ethyl) 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid (2-keto-2-ureido-ethyl) ester Formula: C14H16FN3O7S MolecularWeight: 389.356143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC(=O)NC(=O)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C14H16FN3O7S/c15-11-2-1-9(26(22,23)18-3-5-24-6-4-18)7-10(11)13(20)25-8-12(19)17-14(16)21/h1-2,7H,3-6,8H2,(H3,16,17,19,21)