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

Systemtic Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-2-oxidanylidene-quinolin-3-yl] methanoate Openeye Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-2-oxo-3-quinolyl] formate CAS Name: formic acid [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-2-oxo-3-quinolinyl] ester IUPAC Name: [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-2-oxoquinolin-3-yl] formate Traditional Name: formic acid [4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-keto-7-nitro-3-quinolyl] ester Formula: C26H34N2O6 MolecularWeight: 470.55796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C26H34N2O6/c1-5-6-7-8-15-27-23-17-21(28(31)32)12-13-22(23)24(25(26(27)30)34-18-29)33-16-14-20(4)11-9-10-19(2)3/h10,12-14,17-18H,5-9,11,15-16H2,1-4H3/b20-14+