3-[4-(hydroxymethyl)phenyl]-4-(naphthalen-2-ylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid

Systemtic Name: 3-[4-(hydroxymethyl)phenyl]-4-(naphthalen-2-ylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid Openeye Name: 3-[4-(hydroxymethyl)phenyl]-4-(2-naphthylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid CAS Name: 3-[4-(hydroxymethyl)phenyl]-4-(2-naphthalenylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid IUPAC Name: 3-[4-(hydroxymethyl)phenyl]-4-(naphthalen-2-ylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid Traditional Name: 3-(4-methylolphenyl)-4-(2-naphthylmethoxy)-8-azabicyclo[3.2.1]octane-8-carboxylic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(CC1N2C(=O)O)C3=CC=C(C=C3)CO)OCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC2C(C(CC1N2C(=O)O)C3=CC=C(C=C3)CO)OCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27NO4/c28-15-17-5-9-20(10-6-17)23-14-22-11-12-24(27(22)26(29)30)25(23)31-16-18-7-8-19-3-1-2-4-21(19)13-18/h1-10,13,22-25,28H,11-12,14-16H2,(H,29,30)