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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N-piperonyl-isonipecotamide Formula: C20H21FN2O5S MolecularWeight: 420.454543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C20H21FN2O5S/c21-16-3-1-2-4-19(16)29(25,26)23-9-7-15(8-10-23)20(24)22-12-14-5-6-17-18(11-14)28-13-27-17/h1-6,11,15H,7-10,12-13H2,(H,22,24)