N-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]-1-pyridin-4-yl-ethanamine hydrochloride

Systemtic Name: N-[(3-ethoxy-4-phenylmethoxy-phenyl)methyl]-1-pyridin-4-yl-ethanamine hydrochloride Openeye Name: N-[(4-benzyloxy-3-ethoxy-phenyl)methyl]-1-(4-pyridyl)ethanamine hydrochloride CAS Name: N-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-4-ylethanamine hydrochloride IUPAC Name: N-[(3-ethoxy-4-phenylmethoxyphenyl)methyl]-1-pyridin-4-ylethanamine hydrochloride Traditional Name: (4-benzoxy-3-ethoxy-benzyl)-[1-(4-pyridyl)ethyl]amine hydrochloride Formula: C23H27ClN2O2 MolecularWeight: 398.92568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(C)C2=CC=NC=C2)OCC3=CC=CC=C3.Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(C)C2=CC=NC=C2)OCC3=CC=CC=C3.Cl

InChI

InChI=1S/C23H26N2O2.ClH/c1-3-26-23-15-20(16-25-18(2)21-11-13-24-14-12-21)9-10-22(23)27-17-19-7-5-4-6-8-19;/h4-15,18,25H,3,16-17H2,1-2H3;1H