N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=CC4=C(C=C3)OCCO4

InChI

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