(2R)-1-(4-methylphenyl)-2-nitro-butan-1-one

Systemtic Name: (2R)-1-(4-methylphenyl)-2-nitro-butan-1-one Openeye Name: (2R)-2-nitro-1-(p-tolyl)butan-1-one CAS Name: (2R)-1-(4-methylphenyl)-2-nitro-1-butanone IUPAC Name: (2R)-1-(4-methylphenyl)-2-nitrobutan-1-one Traditional Name: (2R)-2-nitro-1-(p-tolyl)butan-1-one Formula: C11H13NO3 MolecularWeight: 207.22582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3/c1-3-10(12(14)15)11(13)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3/t10-/m1/s1