4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]ethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]ethoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]ethoxy]-2-hydroxy-benzoic acid CAS Name: 4-[2-[3-(1-adamantyl)-4-methoxyphenyl]ethoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[2-[3-(1-adamantyl)-4-methoxyphenyl]ethoxy]-2-hydroxybenzoic acid Traditional Name: 4-[2-[3-(1-adamantyl)-4-methoxy-phenyl]ethoxy]-2-hydroxy-benzoic acid Formula: C26H30O5 MolecularWeight: 422.5134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCOC2=CC(=C(C=C2)C(=O)O)O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=C(C=C1)CCOC2=CC(=C(C=C2)C(=O)O)O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H30O5/c1-30-24-5-2-16(6-7-31-20-3-4-21(25(28)29)23(27)12-20)11-22(24)26-13-17-8-18(14-26)10-19(9-17)15-26/h2-5,11-12,17-19,27H,6-10,13-15H2,1H3,(H,28,29)