[1-butyl-4-(3-methylbut-2-enoxy)-7-nitro-2-oxidanylidene-quinolin-3-yl] methanoate

Systemtic Name: [1-butyl-4-(3-methylbut-2-enoxy)-7-nitro-2-oxidanylidene-quinolin-3-yl] methanoate Openeye Name: [1-butyl-4-(3-methylbut-2-enoxy)-7-nitro-2-oxo-3-quinolyl] formate CAS Name: formic acid [1-butyl-4-(3-methylbut-2-enoxy)-7-nitro-2-oxo-3-quinolinyl] ester IUPAC Name: [1-butyl-4-(3-methylbut-2-enoxy)-7-nitro-2-oxoquinolin-3-yl] formate Traditional Name: formic acid [1-butyl-2-keto-4-(3-methylbut-2-enoxy)-7-nitro-3-quinolyl] ester Formula: C19H22N2O6 MolecularWeight: 374.38778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OCC=C(C)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OCC=C(C)C

InChI

InChI=1S/C19H22N2O6/c1-4-5-9-20-16-11-14(21(24)25)6-7-15(16)17(26-10-8-13(2)3)18(19(20)23)27-12-22/h6-8,11-12H,4-5,9-10H2,1-3H3