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

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl 1H-indazole-3-carboxylate Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (2-bromo-4,5-diethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (2-bromo-4,5-diethoxy-benzyl) ester Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)COC(=O)C2=NNC3=CC=CC=C32)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)COC(=O)C2=NNC3=CC=CC=C32)Br)OCC

InChI

InChI=1S/C19H19BrN2O4/c1-3-24-16-9-12(14(20)10-17(16)25-4-2)11-26-19(23)18-13-7-5-6-8-15(13)21-22-18/h5-10H,3-4,11H2,1-2H3,(H,21,22)