4-[(4-bromanylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid

Systemtic Name: 4-[(4-bromanylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid Openeye Name: 4-[(4-bromopyrazol-1-yl)methyl]thiophene-2-carboxylic acid CAS Name: 4-[(4-bromo-1-pyrazolyl)methyl]-2-thiophenecarboxylic acid IUPAC Name: 4-[(4-bromopyrazol-1-yl)methyl]thiophene-2-carboxylic acid Traditional Name: 4-[(4-bromopyrazol-1-yl)methyl]-2-thenoic acid Formula: C9H7BrN2O2S MolecularWeight: 287.13308

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1CN2C=C(C=N2)Br)C(=O)O

Isomeric SMILES

C1=C(SC=C1CN2C=C(C=N2)Br)C(=O)O

InChI

InChI=1S/C9H7BrN2O2S/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)