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

Systemtic Name: 5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-homoveratryl-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O3/c1-14-19(20(22)25(24-14)16-7-5-4-6-8-16)21(26)23-12-11-15-9-10-17(27-2)18(13-15)28-3/h4-10,13H,11-12H2,1-3H3,(H,23,26)