2-nitro-5-octoxy-benzoic acid

Systemtic Name: 2-nitro-5-octoxy-benzoic acid Openeye Name: 2-nitro-5-octoxy-benzoic acid CAS Name: 2-nitro-5-octoxybenzoic acid IUPAC Name: 2-nitro-5-octoxybenzoic acid Traditional Name: 2-nitro-5-octoxy-benzoic acid Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H21NO5/c1-2-3-4-5-6-7-10-21-12-8-9-14(16(19)20)13(11-12)15(17)18/h8-9,11H,2-7,10H2,1H3,(H,17,18)