3-tert-butyl-5-nitro-4-oxidanyl-benzaldehyde

Systemtic Name: 3-tert-butyl-5-nitro-4-oxidanyl-benzaldehyde Openeye Name: 3-tert-butyl-4-hydroxy-5-nitro-benzaldehyde CAS Name: 3-tert-butyl-4-hydroxy-5-nitrobenzaldehyde IUPAC Name: 3-tert-butyl-4-hydroxy-5-nitrobenzaldehyde Traditional Name: 3-tert-butyl-4-hydroxy-5-nitro-benzaldehyde Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-11(2,3)8-4-7(6-13)5-9(10(8)14)12(15)16/h4-6,14H,1-3H3