4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethyl-piperidin-1-ium-4-ol chloride

Systemtic Name: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethyl-piperidin-1-ium-4-ol chloride Openeye Name: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethyl-piperidin-1-ium-4-ol chloride CAS Name: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethyl-4-piperidin-1-iumol chloride IUPAC Name: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethylpiperidin-1-ium-4-ol chloride Traditional Name: 4-butyl-2,6-bis(4-chlorophenyl)-3,5-dimethyl-piperidin-1-ium-4-ol chloride Formula: C23H30Cl3NO MolecularWeight: 442.8494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(C([NH2+]C(C1C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C)O.[Cl-]

Isomeric SMILES

CCCCC1(C(C([NH2+]C(C1C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C)O.[Cl-]

InChI

InChI=1S/C23H29Cl2NO.ClH/c1-4-5-14-23(27)15(2)21(17-6-10-19(24)11-7-17)26-22(16(23)3)18-8-12-20(25)13-9-18;/h6-13,15-16,21-22,26-27H,4-5,14H2,1-3H3;1H