N-[2-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-oxomethyl]phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]-4-fluorobenzenesulfonamide Traditional Name: 4-fluoro-N-[2-[(piperonyloylamino)carbamoyl]phenyl]benzenesulfonamide Formula: C21H16FN3O6S MolecularWeight: 457.431643

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN3O6S/c22-14-6-8-15(9-7-14)32(28,29)25-17-4-2-1-3-16(17)21(27)24-23-20(26)13-5-10-18-19(11-13)31-12-30-18/h1-11,25H,12H2,(H,23,26)(H,24,27)