(5-ethoxycarbonyloxy-4,4-diphenyl-heptan-2-yl)-dimethyl-azanium chloride

Systemtic Name: (5-ethoxycarbonyloxy-4,4-diphenyl-heptan-2-yl)-dimethyl-azanium chloride Openeye Name: (4-ethoxycarbonyloxy-1-methyl-3,3-diphenyl-hexyl)-dimethyl-ammonium chloride CAS Name: (5-ethoxycarbonyloxy-4,4-diphenylheptan-2-yl)-dimethylammonium chloride IUPAC Name: (5-ethoxycarbonyloxy-4,4-diphenylheptan-2-yl)-dimethylazanium chloride Traditional Name: (4-carbethoxyoxy-1-methyl-3,3-diphenyl-hexyl)-dimethyl-ammonium chloride Formula: C24H34ClNO3 MolecularWeight: 419.98466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)OCC.[Cl-]

Isomeric SMILES

CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)OCC.[Cl-]

InChI

InChI=1S/C24H33NO3.ClH/c1-6-22(28-23(26)27-7-2)24(18-19(3)25(4)5,20-14-10-8-11-15-20)21-16-12-9-13-17-21;/h8-17,19,22H,6-7,18H2,1-5H3;1H