(4-hexoxy-7-nitro-1-octyl-2-oxidanylidene-quinolin-3-yl) methanoate

Systemtic Name: (4-hexoxy-7-nitro-1-octyl-2-oxidanylidene-quinolin-3-yl) methanoate Openeye Name: (4-hexoxy-7-nitro-1-octyl-2-oxo-3-quinolyl) formate CAS Name: formic acid (4-hexoxy-7-nitro-1-octyl-2-oxo-3-quinolinyl) ester IUPAC Name: (4-hexoxy-7-nitro-1-octyl-2-oxoquinolin-3-yl) formate Traditional Name: formic acid (4-hexoxy-2-keto-7-nitro-1-octyl-3-quinolyl) ester Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OCCCCCC

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC=O)OCCCCCC

InChI

InChI=1S/C24H34N2O6/c1-3-5-7-9-10-11-15-25-21-17-19(26(29)30)13-14-20(21)22(23(24(25)28)32-18-27)31-16-12-8-6-4-2/h13-14,17-18H,3-12,15-16H2,1-2H3