[1-(1-adamantyl)-1-oxidanylidene-propan-2-yl] 3-(4-ethanoyl-5-methyl-furan-2-yl)propanoate

Systemtic Name: [1-(1-adamantyl)-1-oxidanylidene-propan-2-yl] 3-(4-ethanoyl-5-methyl-furan-2-yl)propanoate Openeye Name: [2-(1-adamantyl)-1-methyl-2-oxo-ethyl] 3-(4-acetyl-5-methyl-2-furyl)propanoate CAS Name: 3-(4-acetyl-5-methyl-2-furanyl)propanoic acid [1-(1-adamantyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1-adamantyl)-1-oxopropan-2-yl] 3-(4-acetyl-5-methylfuran-2-yl)propanoate Traditional Name: 3-(4-acetyl-5-methyl-2-furyl)propionic acid [2-(1-adamantyl)-2-keto-1-methyl-ethyl] ester Formula: C23H30O5 MolecularWeight: 386.4813

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)OC(C)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)OC(C)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C

InChI

InChI=1S/C23H30O5/c1-13(24)20-9-19(27-14(20)2)4-5-21(25)28-15(3)22(26)23-10-16-6-17(11-23)8-18(7-16)12-23/h9,15-18H,4-8,10-12H2,1-3H3