(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(2-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H17FN4O5S MolecularWeight: 432.425483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H17FN4O5S/c20-14-7-2-4-10-17(14)30(27,28)24-11-5-9-16(24)19(26)29-12-23-18(25)13-6-1-3-8-15(13)21-22-23/h1-4,6-8,10,16H,5,9,11-12H2