3-butoxy-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: 3-butoxy-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]propan-1-amine Openeye Name: 3-butoxy-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]propan-1-amine CAS Name: 3-butoxy-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1-propanamine IUPAC Name: 3-butoxy-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]propan-1-amine Traditional Name: 3-butoxypropyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amine Formula: C17H25N3O MolecularWeight: 287.3999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNCC1=C(NN=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCOCCCNCC1=C(NN=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H25N3O/c1-2-3-11-21-12-7-10-18-13-16-14-19-20-17(16)15-8-5-4-6-9-15/h4-6,8-9,14,18H,2-3,7,10-13H2,1H3,(H,19,20)