triphenylstannyl 2,2-bis(3,5-dimethylpyrazol-1-yl)ethanoate

Systemtic Name: triphenylstannyl 2,2-bis(3,5-dimethylpyrazol-1-yl)ethanoate Openeye Name: triphenylstannyl 2,2-bis(3,5-dimethylpyrazol-1-yl)acetate CAS Name: 2,2-bis(3,5-dimethyl-1-pyrazolyl)acetic acid triphenylstannyl ester IUPAC Name: triphenylstannyl 2,2-bis(3,5-dimethylpyrazol-1-yl)acetate Traditional Name: 2,2-bis(3,5-dimethylpyrazol-1-yl)acetic acid triphenylstannyl ester Formula: C30H30N4O2Sn MolecularWeight: 597.2948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C(=O)O[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C(=CC(=N5)C)C)C

Isomeric SMILES

CC1=CC(=NN1C(C(=O)O[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C(=CC(=N5)C)C)C

InChI

InChI=1S/C12H16N4O2.3C6H5.Sn/c1-7-5-9(3)15(13-7)11(12(17)18)16-10(4)6-8(2)14-16;3*1-2-4-6-5-3-1;/h5-6,11H,1-4H3,(H,17,18);3*1-5H;/q;;;;+1/p-1