[1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxidanylidene-quinolin-3-yl] methanoate

Systemtic Name: [1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxidanylidene-quinolin-3-yl] methanoate Openeye Name: [1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxo-3-quinolyl] formate CAS Name: formic acid [1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxo-3-quinolinyl] ester IUPAC Name: [1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-2-oxoquinolin-3-yl] formate Traditional Name: formic acid [1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-keto-7-nitro-3-quinolyl] ester Formula: C24H30N2O6 MolecularWeight: 442.5048

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)CCC=C(C)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C24H30N2O6/c1-5-6-13-25-21-15-19(26(29)30)10-11-20(21)22(23(24(25)28)32-16-27)31-14-12-18(4)9-7-8-17(2)3/h8,10-12,15-16H,5-7,9,13-14H2,1-4H3/b18-12+