1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-(2-bromo-4,5-dimethoxy-benzyl)-2-keto-5-nitro-nicotinonitrile Formula: C15H12BrN3O5 MolecularWeight: 394.17688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C15H12BrN3O5/c1-23-13-4-10(12(16)5-14(13)24-2)7-18-8-11(19(21)22)3-9(6-17)15(18)20/h3-5,8H,7H2,1-2H3