[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methyl-butyl-(phenylmethyl)azanium

Systemtic Name: [3,5-bis(chloranyl)-2-oxidanyl-phenyl]methyl-butyl-(phenylmethyl)azanium Openeye Name: benzyl-butyl-[(3,5-dichloro-2-hydroxy-phenyl)methyl]ammonium CAS Name: butyl-[(3,5-dichloro-2-hydroxyphenyl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-butyl-[(3,5-dichloro-2-hydroxyphenyl)methyl]azanium Traditional Name: benzyl-butyl-(3,5-dichloro-2-hydroxy-benzyl)ammonium Formula: C18H22Cl2NO+ MolecularWeight: 339.27938

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C18H21Cl2NO/c1-2-3-9-21(12-14-7-5-4-6-8-14)13-15-10-16(19)11-17(20)18(15)22/h4-8,10-11,22H,2-3,9,12-13H2,1H3/p+1