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(2,3,6-trimethylphenyl) 4-(pyrazol-1-ylmethyl)benzoate

(2,3,6-trimethylphenyl) 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name:(2,3,6-trimethylphenyl) 4-(pyrazol-1-ylmethyl)benzoate
Openeye Name:(2,3,6-trimethylphenyl) 4-(pyrazol-1-ylmethyl)benzoate
CAS Name:4-(1-pyrazolylmethyl)benzoic acid (2,3,6-trimethylphenyl) ester
IUPAC Name:(2,3,6-trimethylphenyl) 4-(pyrazol-1-ylmethyl)benzoate
Traditional Name:4-(pyrazol-1-ylmethyl)benzoic acid (2,3,6-trimethylphenyl) ester
Formula: C20H20N2O2
MolecularWeight: 320.385
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC=C(C=C2)CN3C=CC=N3)C


Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC(=O)C2=CC=C(C=C2)CN3C=CC=N3)C


InChI

InChI=1S/C20H20N2O2/c1-14-5-6-15(2)19(16(14)3)24-20(23)18-9-7-17(8-10-18)13-22-12-4-11-21-22/h4-12H,13H2,1-3H3


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