2-[2-(1-adamantyl)-4-oxidanylidene-chromen-6-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-(1-adamantyl)-4-oxidanylidene-chromen-6-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-(1-adamantyl)-4-oxo-chromen-6-yl]-2-oxo-acetic acid CAS Name: 2-[2-(1-adamantyl)-4-oxo-1-benzopyran-6-yl]-2-oxoacetic acid IUPAC Name: 2-[2-(1-adamantyl)-4-oxochromen-6-yl]-2-oxoacetic acid Traditional Name: 2-[2-(1-adamantyl)-4-keto-chromen-6-yl]-2-keto-acetic acid Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=O)C5=C(O4)C=CC(=C5)C(=O)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=O)C5=C(O4)C=CC(=C5)C(=O)C(=O)O

InChI

InChI=1S/C21H20O5/c22-16-7-18(21-8-11-3-12(9-21)5-13(4-11)10-21)26-17-2-1-14(6-15(16)17)19(23)20(24)25/h1-2,6-7,11-13H,3-5,8-10H2,(H,24,25)