3-(naphthalen-2-ylmethoxy)-4-[5-(phenylmethoxymethyl)-1,2,3-triazol-1-yl]piperidine-1-carboxylic acid

Systemtic Name: 3-(naphthalen-2-ylmethoxy)-4-[5-(phenylmethoxymethyl)-1,2,3-triazol-1-yl]piperidine-1-carboxylic acid Openeye Name: 4-[5-(benzyloxymethyl)triazol-1-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid CAS Name: 3-(2-naphthalenylmethoxy)-4-[5-(phenylmethoxymethyl)-1-triazolyl]-1-piperidinecarboxylic acid IUPAC Name: 3-(naphthalen-2-ylmethoxy)-4-[5-(phenylmethoxymethyl)triazol-1-yl]piperidine-1-carboxylic acid Traditional Name: 4-[5-(benzoxymethyl)triazol-1-yl]-3-(2-naphthylmethoxy)piperidine-1-carboxylic acid Formula: C27H28N4O4 MolecularWeight: 472.53562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1N2C(=CN=N2)COCC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

C1CN(CC(C1N2C(=CN=N2)COCC3=CC=CC=C3)OCC4=CC5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C27H28N4O4/c32-27(33)30-13-12-25(31-24(15-28-29-31)19-34-17-20-6-2-1-3-7-20)26(16-30)35-18-21-10-11-22-8-4-5-9-23(22)14-21/h1-11,14-15,25-26H,12-13,16-19H2,(H,32,33)