4-[3-(1-adamantyl)-4-methoxy-phenyl]carbonyloxy-3-methoxy-benzoic acid

Systemtic Name: 4-[3-(1-adamantyl)-4-methoxy-phenyl]carbonyloxy-3-methoxy-benzoic acid Openeye Name: 4-[3-(1-adamantyl)-4-methoxy-benzoyl]oxy-3-methoxy-benzoic acid CAS Name: 4-[[3-(1-adamantyl)-4-methoxyphenyl]-oxomethoxy]-3-methoxybenzoic acid IUPAC Name: 4-[3-(1-adamantyl)-4-methoxybenzoyl]oxy-3-methoxybenzoic acid Traditional Name: 4-[3-(1-adamantyl)-4-methoxy-benzoyl]oxy-3-methoxy-benzoic acid Formula: C26H28O6 MolecularWeight: 436.49692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=O)O)OC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=O)O)OC)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H28O6/c1-30-21-5-4-19(25(29)32-22-6-3-18(24(27)28)11-23(22)31-2)10-20(21)26-12-15-7-16(13-26)9-17(8-15)14-26/h3-6,10-11,15-17H,7-9,12-14H2,1-2H3,(H,27,28)