5-tert-butyl-1-(phenylmethyl)pyrazole-4-carbonyl chloride

Systemtic Name: 5-tert-butyl-1-(phenylmethyl)pyrazole-4-carbonyl chloride Openeye Name: 1-benzyl-5-tert-butyl-pyrazole-4-carbonyl chloride CAS Name: 5-tert-butyl-1-(phenylmethyl)-4-pyrazolecarbonyl chloride IUPAC Name: 1-benzyl-5-tert-butylpyrazole-4-carbonyl chloride Traditional Name: 1-benzyl-5-tert-butyl-pyrazole-4-carbonyl chloride Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=NN1CC2=CC=CC=C2)C(=O)Cl

Isomeric SMILES

CC(C)(C)C1=C(C=NN1CC2=CC=CC=C2)C(=O)Cl

InChI

InChI=1S/C15H17ClN2O/c1-15(2,3)13-12(14(16)19)9-17-18(13)10-11-7-5-4-6-8-11/h4-9H,10H2,1-3H3