N-[[5-(4-chloranyl-3-ethyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine

Systemtic Name: N-[[5-(4-chloranyl-3-ethyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine Openeye Name: N-[[5-(4-chloro-3-ethyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine CAS Name: N-[[5-(4-chloro-3-ethylphenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]ethanamine IUPAC Name: N-[[5-(4-chloro-3-ethylphenoxy)-1,3-dimethylpyrazol-4-yl]methyl]ethanamine Traditional Name: [5-(4-chloro-3-ethyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-ethyl-amine Formula: C16H22ClN3O MolecularWeight: 307.81838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC2=C(C(=NN2C)C)CNCC)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OC2=C(C(=NN2C)C)CNCC)Cl

InChI

InChI=1S/C16H22ClN3O/c1-5-12-9-13(7-8-15(12)17)21-16-14(10-18-6-2)11(3)19-20(16)4/h7-9,18H,5-6,10H2,1-4H3