N-[[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-1-pyridin-4-yl-methanamine

Systemtic Name: N-[[3-bromanyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-1-pyridin-4-yl-methanamine Openeye Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]-1-(4-pyridyl)methanamine CAS Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]-1-pyridin-4-ylmethanamine IUPAC Name: N-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]-1-pyridin-4-ylmethanamine Traditional Name: [3-bromo-4-(2-chlorobenzyl)oxy-5-ethoxy-benzyl]-(4-pyridylmethyl)amine Formula: C22H22BrClN2O2 MolecularWeight: 461.77928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNCC2=CC=NC=C2)Br)OCC3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNCC2=CC=NC=C2)Br)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H22BrClN2O2/c1-2-27-21-12-17(14-26-13-16-7-9-25-10-8-16)11-19(23)22(21)28-15-18-5-3-4-6-20(18)24/h3-12,26H,2,13-15H2,1H3