N-[2-[(5-nitroquinolin-6-yl)amino]ethyl]methanesulfonamide

Systemtic Name: N-[2-[(5-nitroquinolin-6-yl)amino]ethyl]methanesulfonamide Openeye Name: N-[2-[(5-nitro-6-quinolyl)amino]ethyl]methanesulfonamide CAS Name: N-[2-[(5-nitro-6-quinolinyl)amino]ethyl]methanesulfonamide IUPAC Name: N-[2-[(5-nitroquinolin-6-yl)amino]ethyl]methanesulfonamide Traditional Name: N-[2-[(5-nitro-6-quinolyl)amino]ethyl]methanesulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCNC1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NCCNC1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O4S/c1-21(19,20)15-8-7-14-11-5-4-10-9(3-2-6-13-10)12(11)16(17)18/h2-6,14-15H,7-8H2,1H3