1-[(5-chloranylthiophen-2-yl)methyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)methyl]pyrazole-4-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)methyl]pyrazole-4-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)methyl]pyrazole-4-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)methyl]pyrazole-4-carboxylic acid Formula: C9H7ClN2O2S MolecularWeight: 242.68208

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Cl)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1=C(SC(=C1)Cl)CN2C=C(C=N2)C(=O)O

InChI

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