N-[(1-phenylpyrazol-4-yl)methyl]butan-1-amine

Systemtic Name: N-[(1-phenylpyrazol-4-yl)methyl]butan-1-amine Openeye Name: N-[(1-phenylpyrazol-4-yl)methyl]butan-1-amine CAS Name: N-[(1-phenyl-4-pyrazolyl)methyl]-1-butanamine IUPAC Name: N-[(1-phenylpyrazol-4-yl)methyl]butan-1-amine Traditional Name: butyl-[(1-phenylpyrazol-4-yl)methyl]amine Formula: C14H19N3 MolecularWeight: 229.32076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCNCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H19N3/c1-2-3-9-15-10-13-11-16-17(12-13)14-7-5-4-6-8-14/h4-8,11-12,15H,2-3,9-10H2,1H3