6-(4-bromanylphenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 6-(4-bromanylphenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 6-(4-bromophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide CAS Name: 6-(4-bromophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-bromophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 6-(4-bromophenoxy)-N-homoveratryl-nicotinamide Formula: C22H21BrN2O4 MolecularWeight: 457.31714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H21BrN2O4/c1-27-19-9-3-15(13-20(19)28-2)11-12-24-22(26)16-4-10-21(25-14-16)29-18-7-5-17(23)6-8-18/h3-10,13-14H,11-12H2,1-2H3,(H,24,26)