methyl 2-[2-(1-adamantyl)-4-oxidanylidene-chromen-6-yl]ethanoate

Systemtic Name: methyl 2-[2-(1-adamantyl)-4-oxidanylidene-chromen-6-yl]ethanoate Openeye Name: methyl 2-[2-(1-adamantyl)-4-oxo-chromen-6-yl]acetate CAS Name: 2-[2-(1-adamantyl)-4-oxo-1-benzopyran-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1-adamantyl)-4-oxochromen-6-yl]acetate Traditional Name: 2-[2-(1-adamantyl)-4-keto-chromen-6-yl]acetic acid methyl ester Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1)OC(=CC2=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)CC1=CC2=C(C=C1)OC(=CC2=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H24O4/c1-25-21(24)8-13-2-3-19-17(7-13)18(23)9-20(26-19)22-10-14-4-15(11-22)6-16(5-14)12-22/h2-3,7,9,14-16H,4-6,8,10-12H2,1H3