N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-pyrrolidine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-pyrrolidine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-2-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methylpyrrolidine-2-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-piperonyl-pyrrolidine-2-carboxamide Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN2O5S/c1-22(12-14-4-9-18-19(11-14)28-13-27-18)20(24)17-3-2-10-23(17)29(25,26)16-7-5-15(21)6-8-16/h4-9,11,17H,2-3,10,12-13H2,1H3