4-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-2-ethyl-N-homoveratryl-pyrazole-3-carboxamide Formula: C16H20BrN3O3 MolecularWeight: 382.2523

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H20BrN3O3/c1-4-20-15(12(17)10-19-20)16(21)18-8-7-11-5-6-13(22-2)14(9-11)23-3/h5-6,9-10H,4,7-8H2,1-3H3,(H,18,21)