[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2,3,4,5,6-pentamethylbenzoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2,3,4,5,6-pentamethylbenzoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2,3,4,5,6-pentamethylbenzoate CAS Name: 2,3,4,5,6-pentamethylbenzoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2,3,4,5,6-pentamethylbenzoate Traditional Name: 2,3,4,5,6-pentamethylbenzoic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C24H32O3 MolecularWeight: 368.50908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3)C)C

InChI

InChI=1S/C24H32O3/c1-13-14(2)16(4)22(17(5)15(13)3)23(26)27-12-21(25)24-9-18-6-19(10-24)8-20(7-18)11-24/h18-20H,6-12H2,1-5H3