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

Systemtic Name: 3-(naphthalen-2-ylmethoxy)-4-[4-(3-oxidanylpropyl)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-[4-(3-hydroxypropyl)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[4-(3-hydroxypropyl)phenyl]-3-(2-naphthalenylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[4-(3-hydroxypropyl)phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[4-(3-hydroxypropyl)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C26H29NO4 MolecularWeight: 419.51276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29NO4/c28-15-3-4-19-7-11-22(12-8-19)24-13-14-27(26(29)30)17-25(24)31-18-20-9-10-21-5-1-2-6-23(21)16-20/h1-2,5-12,16,24-25,28H,3-4,13-15,17-18H2,(H,29,30)