3-(4-fluoranylphenoxy)propyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxylate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxylate Openeye Name: 3-(4-fluorophenoxy)propyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinecarboxylic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotic acid 3-(4-fluorophenoxy)propyl ester Formula: C23H26FNO7S MolecularWeight: 479.518443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCC1C(=O)OCCCOC2=CC=C(C=C2)F)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H26FNO7S/c24-18-2-4-19(5-3-18)29-12-1-13-32-23(26)17-8-10-25(11-9-17)33(27,28)20-6-7-21-22(16-20)31-15-14-30-21/h2-7,16-17H,1,8-15H2