2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]ethanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]ethanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[(E)-(5-nitro-2-thienyl)methyleneamino]acetamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[(E)-(5-nitro-2-thiophenyl)methylideneamino]acetamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]acetamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[(E)-(5-nitro-2-thienyl)methyleneamino]acetamide Formula: C15H14BrN3O4S MolecularWeight: 412.25836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NN=CC2=CC=C(S2)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-])C)Br

InChI

InChI=1S/C15H14BrN3O4S/c1-9-5-11(16)6-10(2)15(9)23-8-13(20)18-17-7-12-3-4-14(24-12)19(21)22/h3-7H,8H2,1-2H3,(H,18,20)/b17-7+