tert-butyl 2-[(2-oct-1-ynylpyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(2-oct-1-ynylpyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(2-oct-1-ynyl-3-pyridyl)oxymethyl]pyrrolidine-1-carboxylate CAS Name: 2-[(2-oct-1-ynyl-3-pyridinyl)oxymethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-oct-1-ynylpyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(2-oct-1-ynyl-3-pyridyl)oxymethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H34N2O3 MolecularWeight: 386.52766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=C(C=CC=N1)OCC2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC#CC1=C(C=CC=N1)OCC2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C23H34N2O3/c1-5-6-7-8-9-10-14-20-21(15-11-16-24-20)27-18-19-13-12-17-25(19)22(26)28-23(2,3)4/h11,15-16,19H,5-9,12-13,17-18H2,1-4H3