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

Systemtic Name: (2S)-2-ethyl-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]hexan-1-amine Openeye Name: (2S)-2-ethyl-N-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]hexan-1-amine CAS Name: (2S)-2-ethyl-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]-1-hexanamine IUPAC Name: (2S)-2-ethyl-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]hexan-1-amine Traditional Name: [(2S)-2-ethylhexyl]-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]amine Formula: C19H29N3 MolecularWeight: 299.45366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3/c1-4-6-7-16(5-2)12-20-13-18-14-21-22-19(18)17-10-8-15(3)9-11-17/h8-11,14,16,20H,4-7,12-13H2,1-3H3,(H,21,22)/t16-/m0/s1