N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-1-amine

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-1-amine Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]butan-1-amine CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-1-butanamine IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]butan-1-amine Traditional Name: butyl-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]amine Formula: C16H23N3 MolecularWeight: 257.37392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCCNCC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C16H23N3/c1-4-5-11-17-12-16-13(2)18-19(14(16)3)15-9-7-6-8-10-15/h6-10,17H,4-5,11-12H2,1-3H3