6-(4-bromanylphenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(4-bromanylphenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 6-(4-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 6-(4-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 6-(4-bromophenoxy)-N-(3,4,5-trimethoxybenzyl)nicotinamide Formula: C22H21BrN2O5 MolecularWeight: 473.31654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H21BrN2O5/c1-27-18-10-14(11-19(28-2)21(18)29-3)12-25-22(26)15-4-9-20(24-13-15)30-17-7-5-16(23)6-8-17/h4-11,13H,12H2,1-3H3,(H,25,26)