[2-(acetyloxymethyl)-4-ethanoyl-phenyl] adamantane-1-carboxylate

Systemtic Name: [2-(acetyloxymethyl)-4-ethanoyl-phenyl] adamantane-1-carboxylate Openeye Name: [2-(acetoxymethyl)-4-acetyl-phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [4-acetyl-2-(acetyloxymethyl)phenyl] ester IUPAC Name: [4-acetyl-2-(acetyloxymethyl)phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-(acetoxymethyl)-4-acetyl-phenyl] ester Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)C3)COC(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)C3)COC(=O)C

InChI

InChI=1S/C22H26O5/c1-13(23)18-3-4-20(19(8-18)12-26-14(2)24)27-21(25)22-9-15-5-16(10-22)7-17(6-15)11-22/h3-4,8,15-17H,5-7,9-12H2,1-2H3