N-[2-(3-bromophenyl)-5-methyl-pyrazol-3-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: N-[2-(3-bromophenyl)-5-methyl-pyrazol-3-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: N-[2-(3-bromophenyl)-5-methyl-pyrazol-3-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: N-[2-(3-bromophenyl)-5-methyl-3-pyrazolyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: N-[2-(3-bromophenyl)-5-methylpyrazol-3-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: N-[2-(3-bromophenyl)-5-methyl-pyrazol-3-yl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CC2=CC3=C(C=C2)OCCO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CC2=CC3=C(C=C2)OCCO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H18BrN3O3/c1-13-9-19(24(23-13)16-4-2-3-15(21)12-16)22-20(25)11-14-5-6-17-18(10-14)27-8-7-26-17/h2-6,9-10,12H,7-8,11H2,1H3,(H,22,25)