[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C21H31N2O2+ MolecularWeight: 343.48304

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O2/c1-23(7-8-25-19-5-3-2-4-6-19)15-20(24)22-21-12-16-9-17(13-21)11-18(10-16)14-21/h2-6,16-18H,7-15H2,1H3,(H,22,24)/p+1