5-(3,5-dimethylphenoxy)-2-nitro-benzoate

Systemtic Name: 5-(3,5-dimethylphenoxy)-2-nitro-benzoate Openeye Name: 5-(3,5-dimethylphenoxy)-2-nitro-benzoate CAS Name: 5-(3,5-dimethylphenoxy)-2-nitrobenzoate IUPAC Name: 5-(3,5-dimethylphenoxy)-2-nitrobenzoate Traditional Name: 5-(3,5-dimethylphenoxy)-2-nitro-benzoate Formula: C15H12NO5- MolecularWeight: 286.25948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-])C

InChI

InChI=1S/C15H13NO5/c1-9-5-10(2)7-12(6-9)21-11-3-4-14(16(19)20)13(8-11)15(17)18/h3-8H,1-2H3,(H,17,18)/p-1