N-(4-bromanyl-3-methyl-phenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-ethoxy-4-(4-pyridylmethoxy)benzamide CAS Name: N-(4-bromo-3-methylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-ethoxy-4-(4-pyridylmethoxy)benzamide Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)Br)C)OCC3=CC=NC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)Br)C)OCC3=CC=NC=C3

InChI

InChI=1S/C22H21BrN2O3/c1-3-27-21-13-17(22(26)25-18-5-6-19(23)15(2)12-18)4-7-20(21)28-14-16-8-10-24-11-9-16/h4-13H,3,14H2,1-2H3,(H,25,26)