2-(3-bromanylphenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-(3-bromanylphenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(3-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-(3-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(3-bromophenoxy)-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-(3-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=C(N=CC=C2)OC3=CC(=CC=C3)Br

Isomeric SMILES

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

InChI

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