N-[3-[(4-butoxyphenyl)amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-[(4-butoxyphenyl)amino]quinoxalin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(4-butoxyanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(4-butoxyanilino)-2-quinoxalinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-butoxyanilino)quinoxalin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(4-butoxyanilino)quinoxalin-2-yl]-3-nitro-benzenesulfonamide Formula: C24H23N5O5S MolecularWeight: 493.53492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N5O5S/c1-2-3-15-34-19-13-11-17(12-14-19)25-23-24(27-22-10-5-4-9-21(22)26-23)28-35(32,33)20-8-6-7-18(16-20)29(30)31/h4-14,16H,2-3,15H2,1H3,(H,25,26)(H,27,28)