[2-(1-adamantyl)-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 1-(4-chlorophenyl)cyclobutanecarboxylate CAS Name: 1-(4-chlorophenyl)-1-cyclobutanecarboxylic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 1-(4-chlorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)cyclobutanecarboxylic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C23H27ClO3 MolecularWeight: 386.91168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC=C(C=C2)Cl)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC(C1)(C2=CC=C(C=C2)Cl)C(=O)OCC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27ClO3/c24-19-4-2-18(3-5-19)23(6-1-7-23)21(26)27-14-20(25)22-11-15-8-16(12-22)10-17(9-15)13-22/h2-5,15-17H,1,6-14H2