2,3-dimethyl-4-nitro-2-phenyl-butanal

Systemtic Name: 2,3-dimethyl-4-nitro-2-phenyl-butanal Openeye Name: 2,3-dimethyl-4-nitro-2-phenyl-butanal CAS Name: 2,3-dimethyl-4-nitro-2-phenylbutanal IUPAC Name: 2,3-dimethyl-4-nitro-2-phenylbutanal Traditional Name: 2,3-dimethyl-4-nitro-2-phenyl-butyraldehyde Formula: C12H15NO3 MolecularWeight: 221.2524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-10(8-13(15)16)12(2,9-14)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3