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

Systemtic Name: 5-chloranyl-1,3-dimethyl-N-[[2-(phenoxymethyl)phenyl]methyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-1,3-dimethyl-N-[[2-(phenoxymethyl)phenyl]methyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1,3-dimethyl-N-[[2-(phenoxymethyl)phenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1,3-dimethyl-N-[[2-(phenoxymethyl)phenyl]methyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-1,3-dimethyl-N-[2-(phenoxymethyl)benzyl]pyrazole-4-carboxamide Formula: C20H20ClN3O2 MolecularWeight: 369.8447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=CC=C2COC3=CC=CC=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=CC=C2COC3=CC=CC=C3)Cl)C

InChI

InChI=1S/C20H20ClN3O2/c1-14-18(19(21)24(2)23-14)20(25)22-12-15-8-6-7-9-16(15)13-26-17-10-4-3-5-11-17/h3-11H,12-13H2,1-2H3,(H,22,25)