ethyl 2-(4-dodecyl-1,2,3-triazol-1-yl)-2-phenyl-ethanoate

Systemtic Name: ethyl 2-(4-dodecyl-1,2,3-triazol-1-yl)-2-phenyl-ethanoate Openeye Name: ethyl 2-(4-dodecyltriazol-1-yl)-2-phenyl-acetate CAS Name: 2-(4-dodecyl-1-triazolyl)-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-(4-dodecyltriazol-1-yl)-2-phenylacetate Traditional Name: 2-(4-lauryltriazol-1-yl)-2-phenyl-acetic acid ethyl ester Formula: C24H37N3O2 MolecularWeight: 399.56948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN(N=N1)C(C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCC1=CN(N=N1)C(C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C24H37N3O2/c1-3-5-6-7-8-9-10-11-12-16-19-22-20-27(26-25-22)23(24(28)29-4-2)21-17-14-13-15-18-21/h13-15,17-18,20,23H,3-12,16,19H2,1-2H3