2-adamantyl-[2-[2-(4-chloranylphenoxy)ethanoyloxy]ethyl]-methyl-azanium

Systemtic Name: 2-adamantyl-[2-[2-(4-chloranylphenoxy)ethanoyloxy]ethyl]-methyl-azanium Openeye Name: 2-adamantyl-[2-[2-(4-chlorophenoxy)acetyl]oxyethyl]-methyl-ammonium CAS Name: 2-adamantyl-[2-[2-(4-chlorophenoxy)-1-oxoethoxy]ethyl]-methylammonium IUPAC Name: 2-adamantyl-[2-[2-(4-chlorophenoxy)acetyl]oxyethyl]-methylazanium Traditional Name: 2-adamantyl-[2-[2-(4-chlorophenoxy)acetyl]oxyethyl]-methyl-ammonium Formula: C21H29ClNO3+ MolecularWeight: 378.91286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC(=O)COC1=CC=C(C=C1)Cl)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

C[NH+](CCOC(=O)COC1=CC=C(C=C1)Cl)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H28ClNO3/c1-23(21-16-9-14-8-15(11-16)12-17(21)10-14)6-7-25-20(24)13-26-19-4-2-18(22)3-5-19/h2-5,14-17,21H,6-13H2,1H3/p+1