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4-butoxy-1-hexyl-7-nitro-3-octoxy-quinolin-2-one

4-butoxy-1-hexyl-7-nitro-3-octoxy-quinolin-2-one

Systemtic Name:4-butoxy-1-hexyl-7-nitro-3-octoxy-quinolin-2-one
Openeye Name:4-butoxy-1-hexyl-7-nitro-3-octoxy-quinolin-2-one
CAS Name:4-butoxy-1-hexyl-7-nitro-3-octoxy-2-quinolinone
IUPAC Name:4-butoxy-1-hexyl-7-nitro-3-octoxyquinolin-2-one
Traditional Name:4-butoxy-1-hexyl-7-nitro-3-octoxy-carbostyril
Formula: C27H42N2O5
MolecularWeight: 474.63278
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])N(C1=O)CCCCCC)OCCCC


Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])N(C1=O)CCCCCC)OCCCC


InChI

InChI=1S/C27H42N2O5/c1-4-7-10-12-13-15-20-34-26-25(33-19-9-6-3)23-17-16-22(29(31)32)21-24(23)28(27(26)30)18-14-11-8-5-2/h16-17,21H,4-15,18-20H2,1-3H3


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