1-adamantyl-methyl-[2-(phenylcarbonyloxy)ethyl]azanium chloride

Systemtic Name: 1-adamantyl-methyl-[2-(phenylcarbonyloxy)ethyl]azanium chloride Openeye Name: 1-adamantyl-(2-benzoyloxyethyl)-methyl-ammonium chloride CAS Name: 1-adamantyl-(2-benzoyloxyethyl)-methylammonium chloride IUPAC Name: 1-adamantyl-(2-benzoyloxyethyl)-methylazanium chloride Traditional Name: 1-adamantyl-(2-benzoyloxyethyl)-methyl-ammonium chloride Formula: C20H28ClNO2 MolecularWeight: 349.89482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC(=O)C1=CC=CC=C1)C23CC4CC(C2)CC(C4)C3.[Cl-]

Isomeric SMILES

C[NH+](CCOC(=O)C1=CC=CC=C1)C23CC4CC(C2)CC(C4)C3.[Cl-]

InChI

InChI=1S/C20H27NO2.ClH/c1-21(7-8-23-19(22)18-5-3-2-4-6-18)20-12-15-9-16(13-20)11-17(10-15)14-20;/h2-6,15-17H,7-14H2,1H3;1H