3-bromanyl-4-(2,4-dinitrophenoxy)-5-methoxy-benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-(2,4-dinitrophenoxy)-5-methoxy-benzenecarbonitrile Openeye Name: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxy-benzonitrile CAS Name: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzonitrile IUPAC Name: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxybenzonitrile Traditional Name: 3-bromo-4-(2,4-dinitrophenoxy)-5-methoxy-benzonitrile Formula: C14H8BrN3O6 MolecularWeight: 394.13382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C#N)Br)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1)C#N)Br)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H8BrN3O6/c1-23-13-5-8(7-16)4-10(15)14(13)24-12-3-2-9(17(19)20)6-11(12)18(21)22/h2-6H,1H3