N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-4-nitro-benzenesulfonamide CAS Name: N-[4-[(7-chloro-4-quinolinyl)amino]cyclohexyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-4-nitro-benzenesulfonamide Formula: C21H21ClN4O4S MolecularWeight: 460.93384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O4S/c22-14-1-10-19-20(11-12-23-21(19)13-14)24-15-2-4-16(5-3-15)25-31(29,30)18-8-6-17(7-9-18)26(27)28/h1,6-13,15-16,25H,2-5H2,(H,23,24)