2-[(5-bromanyl-2-methoxy-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-(5-bromo-2-methoxy-benzyl)-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C15H14BrN3O2 MolecularWeight: 348.19456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=C(C=CC(=C2)Br)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=C(C=CC(=C2)Br)OC)C#N

InChI

InChI=1S/C15H14BrN3O2/c1-9-10(2)18-19(15(20)13(9)7-17)8-11-6-12(16)4-5-14(11)21-3/h4-6H,8H2,1-3H3