1-[2,5-bis(chloranyl)-3-nitro-phenyl]-3-methyl-butan-1-one

Systemtic Name: 1-[2,5-bis(chloranyl)-3-nitro-phenyl]-3-methyl-butan-1-one Openeye Name: 1-(2,5-dichloro-3-nitro-phenyl)-3-methyl-butan-1-one CAS Name: 1-(2,5-dichloro-3-nitrophenyl)-3-methyl-1-butanone IUPAC Name: 1-(2,5-dichloro-3-nitrophenyl)-3-methylbutan-1-one Traditional Name: 1-(2,5-dichloro-3-nitro-phenyl)-3-methyl-butan-1-one Formula: C11H11Cl2NO3 MolecularWeight: 276.11594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=CC(=CC(=C1Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CC(=O)C1=CC(=CC(=C1Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H11Cl2NO3/c1-6(2)3-10(15)8-4-7(12)5-9(11(8)13)14(16)17/h4-6H,3H2,1-2H3