(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate CAS Name: 2-(5-phenyl-2-tetrazolyl)acetic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate Traditional Name: 2-(5-phenyltetrazol-2-yl)acetic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C22H26N4O2 MolecularWeight: 378.46744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C)C(C)(C)C

InChI

InChI=1S/C22H26N4O2/c1-15-11-18(22(3,4)5)12-16(2)19(15)14-28-20(27)13-26-24-21(23-25-26)17-9-7-6-8-10-17/h6-12H,13-14H2,1-5H3