6-[3-(1-adamantyl)-4-oxidanyl-phenyl]carbonyloxypyridine-3-carboxylic acid

Systemtic Name: 6-[3-(1-adamantyl)-4-oxidanyl-phenyl]carbonyloxypyridine-3-carboxylic acid Openeye Name: 6-[3-(1-adamantyl)-4-hydroxy-benzoyl]oxypyridine-3-carboxylic acid CAS Name: 6-[[3-(1-adamantyl)-4-hydroxyphenyl]-oxomethoxy]-3-pyridinecarboxylic acid IUPAC Name: 6-[3-(1-adamantyl)-4-hydroxybenzoyl]oxypyridine-3-carboxylic acid Traditional Name: 6-[3-(1-adamantyl)-4-hydroxy-benzoyl]oxynicotinic acid Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C(=O)OC5=NC=C(C=C5)C(=O)O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C(=O)OC5=NC=C(C=C5)C(=O)O)O

InChI

InChI=1S/C23H23NO5/c25-19-3-1-16(22(28)29-20-4-2-17(12-24-20)21(26)27)8-18(19)23-9-13-5-14(10-23)7-15(6-13)11-23/h1-4,8,12-15,25H,5-7,9-11H2,(H,26,27)