3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(4-pyridylmethyl)phenyl]propanamide CAS Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(4-pyridylmethyl)phenyl]propionamide Formula: C22H21BrN2O2 MolecularWeight: 425.31834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)Br

InChI

InChI=1S/C22H21BrN2O2/c1-27-21-8-4-17(15-20(21)23)5-9-22(26)25-19-6-2-16(3-7-19)14-18-10-12-24-13-11-18/h2-4,6-8,10-13,15H,5,9,14H2,1H3,(H,25,26)