[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-(2-hydroxyethyl)-phenyl-azanium chloride

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-(2-hydroxyethyl)-phenyl-azanium chloride Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-(2-hydroxyethyl)-phenyl-ammonium chloride CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-(2-hydroxyethyl)-phenylammonium chloride IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-(2-hydroxyethyl)-phenylazanium chloride Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-(2-hydroxyethyl)-phenyl-ammonium chloride Formula: C20H29ClN2O2 MolecularWeight: 364.90946

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C[NH+](CCO)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C[NH+](CCO)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C20H28N2O2.ClH/c23-7-6-22(18-4-2-1-3-5-18)14-19(24)21-20-11-15-8-16(12-20)10-17(9-15)13-20;/h1-5,15-17,23H,6-14H2,(H,21,24);1H