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

Systemtic Name: 4-[3-(1-adamantyl)-4-methoxy-phenoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(1-adamantyl)-4-methoxy-phenoxy]-2-hydroxy-benzoic acid CAS Name: 4-[3-(1-adamantyl)-4-methoxyphenoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(1-adamantyl)-4-methoxyphenoxy]-2-hydroxybenzoic acid Traditional Name: 4-[3-(1-adamantyl)-4-methoxy-phenoxy]-2-hydroxy-benzoic acid Formula: C24H26O5 MolecularWeight: 394.46024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26O5/c1-28-22-5-3-17(29-18-2-4-19(23(26)27)21(25)10-18)9-20(22)24-11-14-6-15(12-24)8-16(7-14)13-24/h2-5,9-10,14-16,25H,6-8,11-13H2,1H3,(H,26,27)