4-[1,2-bis(chloranyl)-2-oxidanylidene-ethyl]-2-nitro-3-propyl-benzoyl chloride

Systemtic Name: 4-[1,2-bis(chloranyl)-2-oxidanylidene-ethyl]-2-nitro-3-propyl-benzoyl chloride Openeye Name: 4-(1,2-dichloro-2-oxo-ethyl)-2-nitro-3-propyl-benzoyl chloride CAS Name: 4-(1,2-dichloro-2-oxoethyl)-2-nitro-3-propylbenzoyl chloride IUPAC Name: 4-(1,2-dichloro-2-oxoethyl)-2-nitro-3-propylbenzoyl chloride Traditional Name: 4-(1,2-dichloro-2-keto-ethyl)-2-nitro-3-propyl-benzoyl chloride Formula: C12H10Cl3NO4 MolecularWeight: 338.5711

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1[N+](=O)[O-])C(=O)Cl)C(C(=O)Cl)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1[N+](=O)[O-])C(=O)Cl)C(C(=O)Cl)Cl

InChI

InChI=1S/C12H10Cl3NO4/c1-2-3-7-6(9(13)12(15)18)4-5-8(11(14)17)10(7)16(19)20/h4-5,9H,2-3H2,1H3