N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2-nitro-benzenesulfonamide Openeye Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-2-nitro-benzenesulfonamide CAS Name: N-[4-[(7-chloro-4-quinolinyl)amino]cyclohexyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-2-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=CC=C4[N+](=O)[O-]

Isomeric SMILES

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

InChI

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