(2-bromanyl-4,5-dimethoxy-phenyl)methyl 1H-indazole-3-carboxylate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl 1H-indazole-3-carboxylate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C17H15BrN2O4 MolecularWeight: 391.216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2=NNC3=CC=CC=C32)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)C2=NNC3=CC=CC=C32)Br)OC

InChI

InChI=1S/C17H15BrN2O4/c1-22-14-7-10(12(18)8-15(14)23-2)9-24-17(21)16-11-5-3-4-6-13(11)19-20-16/h3-8H,9H2,1-2H3,(H,19,20)