4-[(4-chloranylpyrazol-1-yl)methyl]thiophene-2-carboxylate

Systemtic Name: 4-[(4-chloranylpyrazol-1-yl)methyl]thiophene-2-carboxylate Openeye Name: 4-[(4-chloropyrazol-1-yl)methyl]thiophene-2-carboxylate CAS Name: 4-[(4-chloro-1-pyrazolyl)methyl]-2-thiophenecarboxylate IUPAC Name: 4-[(4-chloropyrazol-1-yl)methyl]thiophene-2-carboxylate Traditional Name: 4-[(4-chloropyrazol-1-yl)methyl]-2-thenoate Formula: C9H6ClN2O2S- MolecularWeight: 241.67414

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1CN2C=C(C=N2)Cl)C(=O)[O-]

Isomeric SMILES

C1=C(SC=C1CN2C=C(C=N2)Cl)C(=O)[O-]

InChI

InChI=1S/C9H7ClN2O2S/c10-7-2-11-12(4-7)3-6-1-8(9(13)14)15-5-6/h1-2,4-5H,3H2,(H,13,14)/p-1