2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C16H14BrN3O3 MolecularWeight: 376.20466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=CC3=C(C=C2Br)OCCO3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=CC3=C(C=C2Br)OCCO3)C#N

InChI

InChI=1S/C16H14BrN3O3/c1-9-10(2)19-20(16(21)12(9)7-18)8-11-5-14-15(6-13(11)17)23-4-3-22-14/h5-6H,3-4,8H2,1-2H3