3-[(1R)-1-(2,4-dichlorophenyl)-2-nitro-ethyl]pentane-2,4-dione

Systemtic Name: 3-[(1R)-1-(2,4-dichlorophenyl)-2-nitro-ethyl]pentane-2,4-dione Openeye Name: 3-[(1R)-1-(2,4-dichlorophenyl)-2-nitro-ethyl]pentane-2,4-dione CAS Name: 3-[(1R)-1-(2,4-dichlorophenyl)-2-nitroethyl]pentane-2,4-dione IUPAC Name: 3-[(1R)-1-(2,4-dichlorophenyl)-2-nitroethyl]pentane-2,4-dione Traditional Name: 3-[(1R)-1-(2,4-dichlorophenyl)-2-nitro-ethyl]pentane-2,4-dione Formula: C13H13Cl2NO4 MolecularWeight: 318.15262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13Cl2NO4/c1-7(17)13(8(2)18)11(6-16(19)20)10-4-3-9(14)5-12(10)15/h3-5,11,13H,6H2,1-2H3/t11-/m0/s1