3-methyl-3-nitro-1-phenyl-butan-1-one

Systemtic Name: 3-methyl-3-nitro-1-phenyl-butan-1-one Openeye Name: 3-methyl-3-nitro-1-phenyl-butan-1-one CAS Name: 3-methyl-3-nitro-1-phenyl-1-butanone IUPAC Name: 3-methyl-3-nitro-1-phenylbutan-1-one Traditional Name: 3-methyl-3-nitro-1-phenyl-butan-1-one Formula: C11H13NO3 MolecularWeight: 207.22582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3/c1-11(2,12(14)15)8-10(13)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3