4-chloranyl-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-chloro-N-[3-[4-(3-phenylpropyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]benzenesulfonamide Formula: C28H24ClN4O2S+ MolecularWeight: 516.03376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H24ClN4O2S/c29-23-13-15-24(16-14-23)36(34,35)32-27-28(31-26-12-5-4-11-25(26)30-27)33-19-17-22(18-20-33)10-6-9-21-7-2-1-3-8-21/h1-5,7-8,11-20H,6,9-10H2,(H,30,32)/q+1