(5-nitroquinolin-8-yl) 1-(phenylsulfonyl)cyclopropane-1-carboxylate

Systemtic Name: (5-nitroquinolin-8-yl) 1-(phenylsulfonyl)cyclopropane-1-carboxylate Openeye Name: (5-nitro-8-quinolyl) 1-(benzenesulfonyl)cyclopropanecarboxylate CAS Name: 1-(benzenesulfonyl)-1-cyclopropanecarboxylic acid (5-nitro-8-quinolinyl) ester IUPAC Name: (5-nitroquinolin-8-yl) 1-(benzenesulfonyl)cyclopropane-1-carboxylate Traditional Name: 1-besylcyclopropanecarboxylic acid (5-nitro-8-quinolyl) ester Formula: C19H14N2O6S MolecularWeight: 398.38926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC1(C(=O)OC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H14N2O6S/c22-18(19(10-11-19)28(25,26)13-5-2-1-3-6-13)27-16-9-8-15(21(23)24)14-7-4-12-20-17(14)16/h1-9,12H,10-11H2