[2-[4-(1-adamantyl)-3-methoxy-phenyl]-2H-chromen-6-yl] hydrogen carbonate

Systemtic Name: [2-[4-(1-adamantyl)-3-methoxy-phenyl]-2H-chromen-6-yl] hydrogen carbonate Openeye Name: [2-[4-(1-adamantyl)-3-methoxy-phenyl]-2H-chromen-6-yl] hydrogen carbonate CAS Name: carbonic acid [2-[4-(1-adamantyl)-3-methoxyphenyl]-2H-1-benzopyran-6-yl] ester IUPAC Name: [2-[4-(1-adamantyl)-3-methoxyphenyl]-2H-chromen-6-yl] hydrogen carbonate Traditional Name: carbonic acid [2-[4-(1-adamantyl)-3-methoxy-phenyl]-2H-chromen-6-yl] ester Formula: C27H28O5 MolecularWeight: 432.50822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C=CC3=C(O2)C=CC(=C3)OC(=O)O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2C=CC3=C(O2)C=CC(=C3)OC(=O)O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H28O5/c1-30-25-12-20(23-6-3-19-11-21(31-26(28)29)4-7-24(19)32-23)2-5-22(25)27-13-16-8-17(14-27)10-18(9-16)15-27/h2-7,11-12,16-18,23H,8-10,13-15H2,1H3,(H,28,29)