[2,4-dimethyl-6-oxidanyl-7-(2-phenylphenoxy)heptan-3-yl]azanium chloride

Systemtic Name: [2,4-dimethyl-6-oxidanyl-7-(2-phenylphenoxy)heptan-3-yl]azanium chloride Openeye Name: [4-hydroxy-1-isopropyl-2-methyl-5-(2-phenylphenoxy)pentyl]ammonium chloride CAS Name: [6-hydroxy-2,4-dimethyl-7-(2-phenylphenoxy)heptan-3-yl]ammonium chloride IUPAC Name: [6-hydroxy-2,4-dimethyl-7-(2-phenylphenoxy)heptan-3-yl]azanium chloride Traditional Name: [4-hydroxy-1-isopropyl-2-methyl-5-(2-phenylphenoxy)pentyl]ammonium chloride Formula: C21H30ClNO2 MolecularWeight: 363.9214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)CC(COC1=CC=CC=C1C2=CC=CC=C2)O)[NH3+].[Cl-]

Isomeric SMILES

CC(C)C(C(C)CC(COC1=CC=CC=C1C2=CC=CC=C2)O)[NH3+].[Cl-]

InChI

InChI=1S/C21H29NO2.ClH/c1-15(2)21(22)16(3)13-18(23)14-24-20-12-8-7-11-19(20)17-9-5-4-6-10-17;/h4-12,15-16,18,21,23H,13-14,22H2,1-3H3;1H