1-(4-chlorophenyl)carbonyloxyethyl-bis[(2-methylphenyl)methyl]azanium chloride

Systemtic Name: 1-(4-chlorophenyl)carbonyloxyethyl-bis[(2-methylphenyl)methyl]azanium chloride Openeye Name: 1-(4-chlorobenzoyl)oxyethyl-bis(o-tolylmethyl)ammonium chloride CAS Name: 1-[(4-chlorophenyl)-oxomethoxy]ethyl-bis[(2-methylphenyl)methyl]ammonium chloride IUPAC Name: 1-(4-chlorobenzoyl)oxyethyl-bis[(2-methylphenyl)methyl]azanium chloride Traditional Name: 1-(4-chlorobenzoyl)oxyethyl-bis(2-methylbenzyl)ammonium chloride Formula: C25H27Cl2NO2 MolecularWeight: 444.39338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](CC2=CC=CC=C2C)C(C)OC(=O)C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

CC1=CC=CC=C1C[NH+](CC2=CC=CC=C2C)C(C)OC(=O)C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C25H26ClNO2.ClH/c1-18-8-4-6-10-22(18)16-27(17-23-11-7-5-9-19(23)2)20(3)29-25(28)21-12-14-24(26)15-13-21;/h4-15,20H,16-17H2,1-3H3;1H