[1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 2-(1-adamantyl)ethanoate

Systemtic Name: [1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl] 2-(1-adamantyl)ethanoate Openeye Name: [2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl] 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid [1-(3-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chlorophenyl)-1-oxopropan-2-yl] 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid [2-(3-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C(=O)C1=CC(=CC=C1)Cl)OC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H25ClO3/c1-13(20(24)17-3-2-4-18(22)8-17)25-19(23)12-21-9-14-5-15(10-21)7-16(6-14)11-21/h2-4,8,13-16H,5-7,9-12H2,1H3