methyl 4-[2-(1-adamantyl)ethanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[2-(1-adamantyl)ethanoyloxymethyl]benzoate Openeye Name: methyl 4-[[2-(1-adamantyl)acetyl]oxymethyl]benzoate CAS Name: 4-[[2-(1-adamantyl)-1-oxoethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1-adamantyl)acetyl]oxymethyl]benzoate Traditional Name: 4-[[2-(1-adamantyl)acetyl]oxymethyl]benzoic acid methyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H26O4/c1-24-20(23)18-4-2-14(3-5-18)13-25-19(22)12-21-9-15-6-16(10-21)8-17(7-15)11-21/h2-5,15-17H,6-13H2,1H3