3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(3-bromophenyl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(3-bromophenyl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)Br)C(=O)O

InChI

InChI=1S/C16H11BrN2O2/c17-12-6-4-5-11(9-12)15-14(16(20)21)10-19(18-15)13-7-2-1-3-8-13/h1-10H,(H,20,21)