3-(1-adamantyl)-2-methoxy-4-(4-methoxyphenyl)carbonyloxy-benzoic acid

Systemtic Name: 3-(1-adamantyl)-2-methoxy-4-(4-methoxyphenyl)carbonyloxy-benzoic acid Openeye Name: 3-(1-adamantyl)-2-methoxy-4-(4-methoxybenzoyl)oxy-benzoic acid CAS Name: 3-(1-adamantyl)-2-methoxy-4-[(4-methoxyphenyl)-oxomethoxy]benzoic acid IUPAC Name: 3-(1-adamantyl)-2-methoxy-4-(4-methoxybenzoyl)oxybenzoic acid Traditional Name: 3-(1-adamantyl)-2-methoxy-4-p-anisoyloxy-benzoic acid Formula: C26H28O6 MolecularWeight: 436.49692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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