(4-ethanoylphenyl) 3-chloranyladamantane-1-carboxylate

Systemtic Name: (4-ethanoylphenyl) 3-chloranyladamantane-1-carboxylate Openeye Name: (4-acetylphenyl) 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid (4-acetylphenyl) ester Formula: C19H21ClO3 MolecularWeight: 332.82124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClO3/c1-12(21)15-2-4-16(5-3-15)23-17(22)18-7-13-6-14(8-18)10-19(20,9-13)11-18/h2-5,13-14H,6-11H2,1H3