[3-(3-methylphenoxy)-2-oxidanyl-propyl]-bis(phenylmethyl)azanium chloride

Systemtic Name: [3-(3-methylphenoxy)-2-oxidanyl-propyl]-bis(phenylmethyl)azanium chloride Openeye Name: dibenzyl-[2-hydroxy-3-(3-methylphenoxy)propyl]ammonium chloride CAS Name: [2-hydroxy-3-(3-methylphenoxy)propyl]-bis(phenylmethyl)ammonium chloride IUPAC Name: dibenzyl-[2-hydroxy-3-(3-methylphenoxy)propyl]azanium chloride Traditional Name: dibenzyl-[2-hydroxy-3-(3-methylphenoxy)propyl]ammonium chloride Formula: C24H28ClNO2 MolecularWeight: 397.93762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C24H27NO2.ClH/c1-20-9-8-14-24(15-20)27-19-23(26)18-25(16-21-10-4-2-5-11-21)17-22-12-6-3-7-13-22;/h2-15,23,26H,16-19H2,1H3;1H