bis[3-(4-chlorophenyl)-3-oxidanylidene-propyl]-ethyl-azanium chloride

Systemtic Name: bis[3-(4-chlorophenyl)-3-oxidanylidene-propyl]-ethyl-azanium chloride Openeye Name: bis[3-(4-chlorophenyl)-3-oxo-propyl]-ethyl-ammonium chloride CAS Name: bis[3-(4-chlorophenyl)-3-oxopropyl]-ethylammonium chloride IUPAC Name: bis[3-(4-chlorophenyl)-3-oxopropyl]-ethylazanium chloride Traditional Name: bis[3-(4-chlorophenyl)-3-keto-propyl]-ethyl-ammonium chloride Formula: C20H22Cl3NO2 MolecularWeight: 414.75318

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)C1=CC=C(C=C1)Cl)CCC(=O)C2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CC[NH+](CCC(=O)C1=CC=C(C=C1)Cl)CCC(=O)C2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C20H21Cl2NO2.ClH/c1-2-23(13-11-19(24)15-3-7-17(21)8-4-15)14-12-20(25)16-5-9-18(22)10-6-16;/h3-10H,2,11-14H2,1H3;1H