3-(naphthalen-2-ylmethoxy)-4-[4-(4-oxidanylbutoxy)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 3-(naphthalen-2-ylmethoxy)-4-[4-(4-oxidanylbutoxy)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(4-hydroxybutoxy)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[4-(4-hydroxybutoxy)phenyl]-3-(2-naphthalenylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[4-(4-hydroxybutoxy)phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[4-(4-hydroxybutoxy)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C27H31NO5 MolecularWeight: 449.53874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC=C(C=C2)OCCCCO)OCC3=CC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

C1CN(CC(C1C2=CC=C(C=C2)OCCCCO)OCC3=CC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C27H31NO5/c29-15-3-4-16-32-24-11-9-22(10-12-24)25-13-14-28(27(30)31)18-26(25)33-19-20-7-8-21-5-1-2-6-23(21)17-20/h1-2,5-12,17,25-26,29H,3-4,13-16,18-19H2,(H,30,31)