N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H21N3O3/c1-14-20(15(2)24(23-14)16-8-4-3-5-9-16)21(25)22-12-17-13-26-18-10-6-7-11-19(18)27-17/h3-11,17H,12-13H2,1-2H3,(H,22,25)