2,6-bis(4-chlorophenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2,6-bis(4-chlorophenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2,6-bis(4-chlorophenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol; 2-hydroxy-2-oxo-acetate CAS Name: 2,6-bis(4-chlorophenyl)-3-methyl-4-propyl-4-piperidin-1-iumol; 2-hydroxy-2-oxoacetate IUPAC Name: 2,6-bis(4-chlorophenyl)-3-methyl-4-propylpiperidin-1-ium-4-ol; 2-hydroxy-2-oxoacetate Traditional Name: 2,6-bis(4-chlorophenyl)-3-methyl-4-propyl-piperidin-1-ium-4-ol binoxalate Formula: C23H27Cl2NO5 MolecularWeight: 468.37018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC([NH2+]C(C1C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCCC1(CC([NH2+]C(C1C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C21H25Cl2NO.C2H2O4/c1-3-12-21(25)13-19(15-4-8-17(22)9-5-15)24-20(14(21)2)16-6-10-18(23)11-7-16;3-1(4)2(5)6/h4-11,14,19-20,24-25H,3,12-13H2,1-2H3;(H,3,4)(H,5,6)