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

Systemtic Name: 4-[4-(2-cyanoethyl)phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Openeye Name: 4-[4-(2-cyanoethyl)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 4-[4-(2-cyanoethyl)phenyl]-3-(2-naphthalenylmethoxy)-1-piperidinecarboxylic acid IUPAC Name: 4-[4-(2-cyanoethyl)phenyl]-3-(naphthalen-2-ylmethoxy)piperidine-1-carboxylic acid Traditional Name: 4-[4-(2-cyanoethyl)phenyl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C2=CC=C(C=C2)CCC#N)OCC3=CC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

C1CN(CC(C1C2=CC=C(C=C2)CCC#N)OCC3=CC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C26H26N2O3/c27-14-3-4-19-7-11-22(12-8-19)24-13-15-28(26(29)30)17-25(24)31-18-20-9-10-21-5-1-2-6-23(21)16-20/h1-2,5-12,16,24-25H,3-4,13,15,17-18H2,(H,29,30)