2,2-bis(fluoranyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-1,3-benzodioxole-4-sulfonamide

Systemtic Name: 2,2-bis(fluoranyl)-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-1,3-benzodioxole-4-sulfonamide Openeye Name: 2,2-difluoro-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-1,3-benzodioxole-4-sulfonamide CAS Name: 2,2-difluoro-N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-1,3-benzodioxole-4-sulfonamide IUPAC Name: 2,2-difluoro-N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-1,3-benzodioxole-4-sulfonamide Traditional Name: 2,2-difluoro-N-[4-methoxy-3-(4-methylpiperazino)phenyl]-1,3-benzodioxole-4-sulfonamide Formula: C19H21F2N3O5S MolecularWeight: 441.448946

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3OC(O4)(F)F)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3OC(O4)(F)F)OC

InChI

InChI=1S/C19H21F2N3O5S/c1-23-8-10-24(11-9-23)14-12-13(6-7-15(14)27-2)22-30(25,26)17-5-3-4-16-18(17)29-19(20,21)28-16/h3-7,12,22H,8-11H2,1-2H3