2,5-dimethyl-3-nitro-4-oxidanyl-benzaldehyde

Systemtic Name: 2,5-dimethyl-3-nitro-4-oxidanyl-benzaldehyde Openeye Name: 4-hydroxy-2,5-dimethyl-3-nitro-benzaldehyde CAS Name: 4-hydroxy-2,5-dimethyl-3-nitrobenzaldehyde IUPAC Name: 4-hydroxy-2,5-dimethyl-3-nitrobenzaldehyde Traditional Name: 4-hydroxy-2,5-dimethyl-3-nitro-benzaldehyde Formula: C9H9NO4 MolecularWeight: 195.17206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO4/c1-5-3-7(4-11)6(2)8(9(5)12)10(13)14/h3-4,12H,1-2H3