[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C16H19FN2O7S MolecularWeight: 402.394663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)COC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)NC(=O)COC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FN2O7S/c1-2-25-16(22)18-14(20)10-26-15(21)13-4-3-9-19(13)27(23,24)12-7-5-11(17)6-8-12/h5-8,13H,2-4,9-10H2,1H3,(H,18,20,22)/t13-/m0/s1