3-chloranyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[3-(2-morpholin-4-ium-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 3-chloro-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 3-chloro-N-[3-(2-morpholin-4-ium-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[3-(2-morpholin-4-ium-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide Formula: C20H23ClN5O3S+ MolecularWeight: 448.94632

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H22ClN5O3S/c21-15-4-3-5-16(14-15)30(27,28)25-20-19(22-8-9-26-10-12-29-13-11-26)23-17-6-1-2-7-18(17)24-20/h1-7,14H,8-13H2,(H,22,23)(H,24,25)/p+1