(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethylpyrazol-1-yl)methanone

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethylpyrazol-1-yl)methanone Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethylpyrazol-1-yl)methanone CAS Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethyl-1-pyrazolyl)methanone IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethylpyrazol-1-yl)methanone Traditional Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3,5-dimethylpyrazol-1-yl)methanone Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=CC3=C(C=C2Br)OCCO3)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=CC3=C(C=C2Br)OCCO3)C

InChI

InChI=1S/C14H13BrN2O3/c1-8-5-9(2)17(16-8)14(18)10-6-12-13(7-11(10)15)20-4-3-19-12/h5-7H,3-4H2,1-2H3