[3-[3-[4-(1-adamantyl)-3-methoxy-phenyl]-6-carboxyoxy-2-methoxy-phenyl]phenyl] hydrogen carbonate

Systemtic Name: [3-[3-[4-(1-adamantyl)-3-methoxy-phenyl]-6-carboxyoxy-2-methoxy-phenyl]phenyl] hydrogen carbonate Openeye Name: [3-[3-[4-(1-adamantyl)-3-methoxy-phenyl]-6-carboxyoxy-2-methoxy-phenyl]phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[3-[4-(1-adamantyl)-3-methoxyphenyl]-6-carboxyoxy-2-methoxyphenyl]phenyl] ester IUPAC Name: [3-[3-[4-(1-adamantyl)-3-methoxyphenyl]-6-carboxyoxy-2-methoxyphenyl]phenyl] hydrogen carbonate Traditional Name: carbonic acid [3-[3-[4-(1-adamantyl)-3-methoxy-phenyl]-6-carboxyoxy-2-methoxy-phenyl]phenyl] ester Formula: C32H32O8 MolecularWeight: 544.59168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H32O8/c1-37-27-14-21(6-8-25(27)32-15-18-10-19(16-32)12-20(11-18)17-32)24-7-9-26(40-31(35)36)28(29(24)38-2)22-4-3-5-23(13-22)39-30(33)34/h3-9,13-14,18-20H,10-12,15-17H2,1-2H3,(H,33,34)(H,35,36)