(2S)-2-ethyl-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]hexan-1-amine

Systemtic Name: (2S)-2-ethyl-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]hexan-1-amine Openeye Name: (2S)-2-ethyl-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]hexan-1-amine CAS Name: (2S)-2-ethyl-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1-hexanamine IUPAC Name: (2S)-2-ethyl-N-[(5-phenyl-1H-pyrazol-4-yl)methyl]hexan-1-amine Traditional Name: [(2S)-2-ethylhexyl]-[(5-phenyl-1H-pyrazol-4-yl)methyl]amine Formula: C18H27N3 MolecularWeight: 285.42708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNCC1=C(NN=C1)C2=CC=CC=C2

Isomeric SMILES

CCCC[C@H](CC)CNCC1=C(NN=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H27N3/c1-3-5-9-15(4-2)12-19-13-17-14-20-21-18(17)16-10-7-6-8-11-16/h6-8,10-11,14-15,19H,3-5,9,12-13H2,1-2H3,(H,20,21)/t15-/m0/s1