N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-pyridin-3-yl-ethanamine

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-pyridin-3-yl-ethanamine Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyl]-1-(3-pyridyl)ethanamine CAS Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-(3-pyridinyl)ethanamine IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-pyridin-3-ylethanamine Traditional Name: (5-bromo-2-propoxy-benzyl)-[1-(3-pyridyl)ethyl]amine Formula: C17H21BrN2O MolecularWeight: 349.26544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)CNC(C)C2=CN=CC=C2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)CNC(C)C2=CN=CC=C2

InChI

InChI=1S/C17H21BrN2O/c1-3-9-21-17-7-6-16(18)10-15(17)12-20-13(2)14-5-4-8-19-11-14/h4-8,10-11,13,20H,3,9,12H2,1-2H3