2-chloranylprop-2-enyl 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate

Systemtic Name: 2-chloranylprop-2-enyl 1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxylate Openeye Name: 2-chloroallyl 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxylic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 1-phenyl-3-thiophen-2-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(2-thienyl)pyrazole-4-carboxylic acid 2-chloroallyl ester Formula: C17H13ClN2O2S MolecularWeight: 344.81532

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)Cl

Isomeric SMILES

C=C(COC(=O)C1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H13ClN2O2S/c1-12(18)11-22-17(21)14-10-20(13-6-3-2-4-7-13)19-16(14)15-8-5-9-23-15/h2-10H,1,11H2