2-(2-dodecyl-1,2,3,4-tetrazol-5-yl)-2-phenyl-ethanoic acid

Systemtic Name: 2-(2-dodecyl-1,2,3,4-tetrazol-5-yl)-2-phenyl-ethanoic acid Openeye Name: 2-(2-dodecyltetrazol-5-yl)-2-phenyl-acetic acid CAS Name: 2-(2-dodecyl-5-tetrazolyl)-2-phenylacetic acid IUPAC Name: 2-(2-dodecyltetrazol-5-yl)-2-phenylacetic acid Traditional Name: 2-(2-lauryltetrazol-5-yl)-2-phenyl-acetic acid Formula: C21H32N4O2 MolecularWeight: 372.50438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1N=C(N=N1)C(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCN1N=C(N=N1)C(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H32N4O2/c1-2-3-4-5-6-7-8-9-10-14-17-25-23-20(22-24-25)19(21(26)27)18-15-12-11-13-16-18/h11-13,15-16,19H,2-10,14,17H2,1H3,(H,26,27)