[(E)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate

Systemtic Name: [(E)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate Openeye Name: [(E)-[amino-(4-nitrophenyl)methylene]amino] 2-(2-bromo-4-methyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-methylphenoxy)acetic acid [(E)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(E)-[amino-(4-nitrophenyl)methylidene]amino] 2-(2-bromo-4-methylphenoxy)acetate Traditional Name: 2-(2-bromo-4-methyl-phenoxy)acetic acid [(E)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C16H14BrN3O5 MolecularWeight: 408.20346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)O/N=C(\C2=CC=C(C=C2)[N+](=O)[O-])/N)Br

InChI

InChI=1S/C16H14BrN3O5/c1-10-2-7-14(13(17)8-10)24-9-15(21)25-19-16(18)11-3-5-12(6-4-11)20(22)23/h2-8H,9H2,1H3,(H2,18,19)