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4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one

4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one

Systemtic Name:4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one
Openeye Name:4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one
CAS Name:4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-2-quinolinone
IUPAC Name:4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octylquinolin-2-one
Traditional Name:4-butoxy-3-(2-methylpentoxy)-7-nitro-1-octyl-carbostyril
Formula: C27H42N2O5
MolecularWeight: 474.63278
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OCCCC


Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OCCCC


InChI

InChI=1S/C27H42N2O5/c1-5-8-10-11-12-13-17-28-24-19-22(29(31)32)15-16-23(24)25(33-18-9-6-2)26(27(28)30)34-20-21(4)14-7-3/h15-16,19,21H,5-14,17-18,20H2,1-4H3


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