[4-(2,5-dimethoxyphenyl)-4-oxidanyl-octan-2-yl]-diethyl-azanium chloride

Systemtic Name: [4-(2,5-dimethoxyphenyl)-4-oxidanyl-octan-2-yl]-diethyl-azanium chloride Openeye Name: [3-(2,5-dimethoxyphenyl)-3-hydroxy-1-methyl-heptyl]-diethyl-ammonium chloride CAS Name: [4-(2,5-dimethoxyphenyl)-4-hydroxyoctan-2-yl]-diethylammonium chloride IUPAC Name: [4-(2,5-dimethoxyphenyl)-4-hydroxyoctan-2-yl]-diethylazanium chloride Traditional Name: [3-(2,5-dimethoxyphenyl)-3-hydroxy-1-methyl-heptyl]-diethyl-ammonium chloride Formula: C20H36ClNO3 MolecularWeight: 373.95774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)[NH+](CC)CC)(C1=C(C=CC(=C1)OC)OC)O.[Cl-]

Isomeric SMILES

CCCCC(CC(C)[NH+](CC)CC)(C1=C(C=CC(=C1)OC)OC)O.[Cl-]

InChI

InChI=1S/C20H35NO3.ClH/c1-7-10-13-20(22,15-16(4)21(8-2)9-3)18-14-17(23-5)11-12-19(18)24-6;/h11-12,14,16,22H,7-10,13,15H2,1-6H3;1H