2-(4-fluoranylphenoxy)ethyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: 2-(4-fluorophenoxy)ethyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyrrolidinecarboxylic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylic acid 2-(4-fluorophenoxy)ethyl ester Formula: C21H22FNO7S MolecularWeight: 451.465283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OCCOC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3)C(=O)OCCOC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FNO7S/c22-15-3-5-16(6-4-15)27-10-13-30-21(24)18-2-1-9-23(18)31(25,26)17-7-8-19-20(14-17)29-12-11-28-19/h3-8,14,18H,1-2,9-13H2