N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-pyrazol-1-yl-propan-2-amine

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1-pyrazol-1-yl-propan-2-amine Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyl]-1-pyrazol-1-yl-propan-2-amine CAS Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-(1-pyrazolyl)-2-propanamine IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1-pyrazol-1-ylpropan-2-amine Traditional Name: (5-bromo-2-propoxy-benzyl)-(1-methyl-2-pyrazol-1-yl-ethyl)amine Formula: C16H22BrN3O MolecularWeight: 352.26938

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)CNC(C)CN2C=CC=N2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)CNC(C)CN2C=CC=N2

InChI

InChI=1S/C16H22BrN3O/c1-3-9-21-16-6-5-15(17)10-14(16)11-18-13(2)12-20-8-4-7-19-20/h4-8,10,13,18H,3,9,11-12H2,1-2H3