tris(2-methyl-2-phenyl-propyl)stannyl 5-chloranyl-3-ethyl-1-methyl-pyrazole-4-carboxylate

Systemtic Name: tris(2-methyl-2-phenyl-propyl)stannyl 5-chloranyl-3-ethyl-1-methyl-pyrazole-4-carboxylate Openeye Name: tris(2-methyl-2-phenyl-propyl)stannyl 5-chloro-3-ethyl-1-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-ethyl-1-methyl-4-pyrazolecarboxylic acid tris(2-methyl-2-phenylpropyl)stannyl ester IUPAC Name: tris(2-methyl-2-phenylpropyl)stannyl 5-chloro-3-ethyl-1-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-3-ethyl-1-methyl-pyrazole-4-carboxylic acid trineophylstannyl ester Formula: C37H47ClN2O2Sn MolecularWeight: 705.94428

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O[Sn](CC(C)(C)C2=CC=CC=C2)(CC(C)(C)C3=CC=CC=C3)CC(C)(C)C4=CC=CC=C4)Cl)C

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O[Sn](CC(C)(C)C2=CC=CC=C2)(CC(C)(C)C3=CC=CC=C3)CC(C)(C)C4=CC=CC=C4)Cl)C

InChI

InChI=1S/3C10H13.C7H9ClN2O2.Sn/c3*1-10(2,3)9-7-5-4-6-8-9;1-3-4-5(7(11)12)6(8)10(2)9-4;/h3*4-8H,1H2,2-3H3;3H2,1-2H3,(H,11,12);/q;;;;+1/p-1