3-(3-bromanyl-4-phenylmethoxy-phenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(3-bromanyl-4-phenylmethoxy-phenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(4-benzyloxy-3-bromo-phenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(3-bromo-4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(3-bromo-4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(4-benzoxy-3-bromo-phenyl)-1H-pyrazole-5-carboxylic acid Formula: C17H13BrN2O3 MolecularWeight: 373.20072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NNC(=C3)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NNC(=C3)C(=O)O)Br

InChI

InChI=1S/C17H13BrN2O3/c18-13-8-12(14-9-15(17(21)22)20-19-14)6-7-16(13)23-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,19,20)(H,21,22)