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5-nitro-2,4-dioctoxy-benzoic acid

5-nitro-2,4-dioctoxy-benzoic acid

Systemtic Name:5-nitro-2,4-dioctoxy-benzoic acid
Openeye Name:5-nitro-2,4-dioctoxy-benzoic acid
CAS Name:5-nitro-2,4-dioctoxybenzoic acid
IUPAC Name:5-nitro-2,4-dioctoxybenzoic acid
Traditional Name:5-nitro-2,4-dioctoxy-benzoic acid
Formula: C23H37NO6
MolecularWeight: 423.54298
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCCCCCCCC


Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCCCCCCCC


InChI

InChI=1S/C23H37NO6/c1-3-5-7-9-11-13-15-29-21-18-22(30-16-14-12-10-8-6-4-2)20(24(27)28)17-19(21)23(25)26/h17-18H,3-16H2,1-2H3,(H,25,26)


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