N-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-N-prop-2-ynyl-prop-2-en-1-amine

Systemtic Name: N-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-N-prop-2-ynyl-prop-2-en-1-amine Openeye Name: N-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-N-prop-2-ynyl-prop-2-en-1-amine CAS Name: N-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-N-prop-2-ynyl-2-propen-1-amine IUPAC Name: N-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-N-prop-2-ynylprop-2-en-1-amine Traditional Name: allyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]-propargyl-amine Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=NN2)CN(CC=C)CC#C)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=NN2)CN(CC=C)CC#C)OC

InChI

InChI=1S/C18H21N3O2/c1-5-9-21(10-6-2)13-14-12-19-20-18(14)16-8-7-15(22-3)11-17(16)23-4/h1,6-8,11-12H,2,9-10,13H2,3-4H3,(H,19,20)