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

Systemtic Name: N-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]-1-pyridin-2-yl-methanamine hydrochloride Openeye Name: N-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyl]-1-(2-pyridyl)methanamine hydrochloride CAS Name: N-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]-1-(2-pyridinyl)methanamine hydrochloride IUPAC Name: N-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-2-ylmethanamine hydrochloride Traditional Name: (4-benzoxy-3-bromo-5-ethoxy-benzyl)-(2-pyridylmethyl)amine hydrochloride Formula: C22H24BrClN2O2 MolecularWeight: 463.79516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNCC2=CC=CC=N2)Br)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNCC2=CC=CC=N2)Br)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C22H23BrN2O2.ClH/c1-2-26-21-13-18(14-24-15-19-10-6-7-11-25-19)12-20(23)22(21)27-16-17-8-4-3-5-9-17;/h3-13,24H,2,14-16H2,1H3;1H