2,4-bis(2-methylpropoxy)-5-nitro-benzoic acid

Systemtic Name: 2,4-bis(2-methylpropoxy)-5-nitro-benzoic acid Openeye Name: 2,4-diisobutoxy-5-nitro-benzoic acid CAS Name: 2,4-bis(2-methylpropoxy)-5-nitrobenzoic acid IUPAC Name: 2,4-bis(2-methylpropoxy)-5-nitrobenzoic acid Traditional Name: 2,4-diisobutoxy-5-nitro-benzoic acid Formula: C15H21NO6 MolecularWeight: 311.33034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCC(C)C

Isomeric SMILES

CC(C)COC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCC(C)C

InChI

InChI=1S/C15H21NO6/c1-9(2)7-21-13-6-14(22-8-10(3)4)12(16(19)20)5-11(13)15(17)18/h5-6,9-10H,7-8H2,1-4H3,(H,17,18)