N-[3-(1,3-benzodioxol-5-ylmethylamino)quinoxalin-2-yl]-3-chloranyl-benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)quinoxalin-2-yl]-3-chloranyl-benzenesulfonamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)quinoxalin-2-yl]-3-chloro-benzenesulfonamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-2-quinoxalinyl]-3-chlorobenzenesulfonamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)quinoxalin-2-yl]-3-chlorobenzenesulfonamide Traditional Name: 3-chloro-N-[3-(piperonylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C22H17ClN4O4S MolecularWeight: 468.91278

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H17ClN4O4S/c23-15-4-3-5-16(11-15)32(28,29)27-22-21(25-17-6-1-2-7-18(17)26-22)24-12-14-8-9-19-20(10-14)31-13-30-19/h1-11H,12-13H2,(H,24,25)(H,26,27)