[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 3-chloranyladamantane-1-carboxylate

Systemtic Name: [1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 3-chloranyladamantane-1-carboxylate Openeye Name: [2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl] 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid [1-(3-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chlorophenyl)-1-oxopropan-2-yl] 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid [2-(3-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H22Cl2O3 MolecularWeight: 381.29288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22Cl2O3/c1-12(17(23)15-3-2-4-16(21)6-15)25-18(24)19-7-13-5-14(8-19)10-20(22,9-13)11-19/h2-4,6,12-14H,5,7-11H2,1H3