2-(3,4-dimethoxyphenyl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ethanamine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ethanamine Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ethanamine CAS Name: 2-(3,4-dimethoxyphenyl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ethanamine IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ethanamine Traditional Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-homoveratryl-amine Formula: C20H22FN3O2 MolecularWeight: 355.405983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC2=C(NN=C2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC2=C(NN=C2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H22FN3O2/c1-25-18-8-3-14(11-19(18)26-2)9-10-22-12-16-13-23-24-20(16)15-4-6-17(21)7-5-15/h3-8,11,13,22H,9-10,12H2,1-2H3,(H,23,24)