5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dimethylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-homoveratryl-1,3-dimethyl-pyrazole-4-carboxamide Formula: C16H20ClN3O3 MolecularWeight: 337.8013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C

InChI

InChI=1S/C16H20ClN3O3/c1-10-14(15(17)20(2)19-10)16(21)18-8-7-11-5-6-12(22-3)13(9-11)23-4/h5-6,9H,7-8H2,1-4H3,(H,18,21)