N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]propan-1-amine

Systemtic Name: N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]propan-1-amine Openeye Name: N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]propan-1-amine CAS Name: N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-1-propanamine IUPAC Name: N-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]propan-1-amine Traditional Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl-propyl-amine Formula: C13H16ClN3 MolecularWeight: 249.73924

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(NN=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCNCC1=C(NN=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H16ClN3/c1-2-7-15-8-11-9-16-17-13(11)10-3-5-12(14)6-4-10/h3-6,9,15H,2,7-8H2,1H3,(H,16,17)