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

Systemtic Name: 3-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]-4-oxidanyl-benzoic acid Openeye Name: 3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-4-hydroxy-benzoic acid CAS Name: 3-[[2-[4-(1-adamantyl)phenoxy]-1-oxoethyl]amino]-4-hydroxybenzoic acid IUPAC Name: 3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-4-hydroxybenzoic acid Traditional Name: 3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-4-hydroxy-benzoic acid Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCC(=O)NC5=C(C=CC(=C5)C(=O)O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCC(=O)NC5=C(C=CC(=C5)C(=O)O)O

InChI

InChI=1S/C25H27NO5/c27-22-6-1-18(24(29)30)10-21(22)26-23(28)14-31-20-4-2-19(3-5-20)25-11-15-7-16(12-25)9-17(8-15)13-25/h1-6,10,15-17,27H,7-9,11-14H2,(H,26,28)(H,29,30)