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2-[6-(5-nitro-2-phenyl-phenoxy)hexoxy]terephthalic acid

2-[6-(5-nitro-2-phenyl-phenoxy)hexoxy]terephthalic acid

Systemtic Name:2-[6-(5-nitro-2-phenyl-phenoxy)hexoxy]terephthalic acid
Openeye Name:2-[6-(5-nitro-2-phenyl-phenoxy)hexoxy]terephthalic acid
CAS Name:2-[6-(5-nitro-2-phenylphenoxy)hexoxy]terephthalic acid
IUPAC Name:2-[6-(5-nitro-2-phenylphenoxy)hexoxy]terephthalic acid
Traditional Name:2-[6-(5-nitro-2-phenyl-phenoxy)hexoxy]terephthalic acid
Formula: C26H25NO8
MolecularWeight: 479.4786
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])OCCCCCCOC3=C(C=CC(=C3)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])OCCCCCCOC3=C(C=CC(=C3)C(=O)O)C(=O)O


InChI

InChI=1S/C26H25NO8/c28-25(29)19-10-12-22(26(30)31)23(16-19)34-14-6-1-2-7-15-35-24-17-20(27(32)33)11-13-21(24)18-8-4-3-5-9-18/h3-5,8-13,16-17H,1-2,6-7,14-15H2,(H,28,29)(H,30,31)


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