(4-bromanyl-2,5-dimethoxy-phenyl)methyl pyridine-4-carboxylate

Systemtic Name: (4-bromanyl-2,5-dimethoxy-phenyl)methyl pyridine-4-carboxylate Openeye Name: (4-bromo-2,5-dimethoxy-phenyl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (4-bromo-2,5-dimethoxyphenyl)methyl ester IUPAC Name: (4-bromo-2,5-dimethoxyphenyl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (4-bromo-2,5-dimethoxy-benzyl) ester Formula: C15H14BrNO4 MolecularWeight: 352.17996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1COC(=O)C2=CC=NC=C2)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1COC(=O)C2=CC=NC=C2)OC)Br

InChI

InChI=1S/C15H14BrNO4/c1-19-13-8-12(16)14(20-2)7-11(13)9-21-15(18)10-3-5-17-6-4-10/h3-8H,9H2,1-2H3