1-(4-bromophenyl)-4-methyl-4-nitro-pentan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-methyl-4-nitro-pentan-1-one Openeye Name: 1-(4-bromophenyl)-4-methyl-4-nitro-pentan-1-one CAS Name: 1-(4-bromophenyl)-4-methyl-4-nitro-1-pentanone IUPAC Name: 1-(4-bromophenyl)-4-methyl-4-nitropentan-1-one Traditional Name: 1-(4-bromophenyl)-4-methyl-4-nitro-pentan-1-one Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO3/c1-12(2,14(16)17)8-7-11(15)9-3-5-10(13)6-4-9/h3-6H,7-8H2,1-2H3