[(E)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-bromanyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [(E)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-bromanyl-3-methyl-phenoxy)ethanoate Openeye Name: [(E)-[amino-(4-nitrophenyl)methylene]amino] 2-(4-bromo-3-methyl-phenoxy)acetate CAS Name: 2-(4-bromo-3-methylphenoxy)acetic acid [(E)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(E)-[amino-(4-nitrophenyl)methylidene]amino] 2-(4-bromo-3-methylphenoxy)acetate Traditional Name: 2-(4-bromo-3-methyl-phenoxy)acetic acid [(E)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C16H14BrN3O5 MolecularWeight: 408.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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