[4-(2-methylpropyl)-2-nitro-phenyl]boronic acid

Systemtic Name: [4-(2-methylpropyl)-2-nitro-phenyl]boronic acid Openeye Name: (4-isobutyl-2-nitro-phenyl)boronic acid CAS Name: [4-(2-methylpropyl)-2-nitrophenyl]boronic acid IUPAC Name: [4-(2-methylpropyl)-2-nitrophenyl]boronic acid Traditional Name: (4-isobutyl-2-nitro-phenyl)boronic acid Formula: C10H14BNO4 MolecularWeight: 223.03346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14BNO4/c1-7(2)5-8-3-4-9(11(13)14)10(6-8)12(15)16/h3-4,6-7,13-14H,5H2,1-2H3