[2-[3-(1-adamantyl)-4-methoxy-phenyl]-1-benzofuran-5-yl] hydrogen carbonate

Systemtic Name: [2-[3-(1-adamantyl)-4-methoxy-phenyl]-1-benzofuran-5-yl] hydrogen carbonate Openeye Name: [2-[3-(1-adamantyl)-4-methoxy-phenyl]benzofuran-5-yl] hydrogen carbonate CAS Name: carbonic acid [2-[3-(1-adamantyl)-4-methoxyphenyl]-5-benzofuranyl] ester IUPAC Name: [2-[3-(1-adamantyl)-4-methoxyphenyl]-1-benzofuran-5-yl] hydrogen carbonate Traditional Name: carbonic acid [2-[3-(1-adamantyl)-4-methoxy-phenyl]benzofuran-5-yl] ester Formula: C26H26O5 MolecularWeight: 418.48164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=C(O2)C=CC(=C3)OC(=O)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=C(O2)C=CC(=C3)OC(=O)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H26O5/c1-29-23-4-2-18(24-11-19-9-20(30-25(27)28)3-5-22(19)31-24)10-21(23)26-12-15-6-16(13-26)8-17(7-15)14-26/h2-5,9-11,15-17H,6-8,12-14H2,1H3,(H,27,28)