4-(1-adamantyl)-2-[(5-ethylfuran-2-yl)methyl]-3-oxidanylidene-butanoic acid

Systemtic Name: 4-(1-adamantyl)-2-[(5-ethylfuran-2-yl)methyl]-3-oxidanylidene-butanoic acid Openeye Name: 4-(1-adamantyl)-2-[(5-ethyl-2-furyl)methyl]-3-oxo-butanoic acid CAS Name: 4-(1-adamantyl)-2-[(5-ethyl-2-furanyl)methyl]-3-oxobutanoic acid IUPAC Name: 4-(1-adamantyl)-2-[(5-ethylfuran-2-yl)methyl]-3-oxobutanoic acid Traditional Name: 4-(1-adamantyl)-2-[(5-ethyl-2-furyl)methyl]-3-keto-butyric acid Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)CC(C(=O)CC23CC4CC(C2)CC(C4)C3)C(=O)O

Isomeric SMILES

CCC1=CC=C(O1)CC(C(=O)CC23CC4CC(C2)CC(C4)C3)C(=O)O

InChI

InChI=1S/C21H28O4/c1-2-16-3-4-17(25-16)8-18(20(23)24)19(22)12-21-9-13-5-14(10-21)7-15(6-13)11-21/h3-4,13-15,18H,2,5-12H2,1H3,(H,23,24)