(2-ethylpyrazol-3-yl) 4-methyl-2-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-ethylpyrazol-3-yl) 4-methyl-2-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (2-ethylpyrazol-3-yl) 4-methyl-2-(4-methyl-5-oxo-tetrazol-1-yl)benzoate CAS Name: 4-methyl-2-(4-methyl-5-oxo-1-tetrazolyl)benzoic acid (2-ethyl-3-pyrazolyl) ester IUPAC Name: (2-ethylpyrazol-3-yl) 4-methyl-2-(4-methyl-5-oxotetrazol-1-yl)benzoate Traditional Name: 2-(5-keto-4-methyl-tetrazol-1-yl)-4-methyl-benzoic acid (2-ethylpyrazol-3-yl) ester Formula: C15H16N6O3 MolecularWeight: 328.32594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)C)N3C(=O)N(N=N3)C

Isomeric SMILES

CCN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)C)N3C(=O)N(N=N3)C

InChI

InChI=1S/C15H16N6O3/c1-4-20-13(7-8-16-20)24-14(22)11-6-5-10(2)9-12(11)21-15(23)19(3)17-18-21/h5-9H,4H2,1-3H3