ethyl 2-[2-bromanyl-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-bromanyl-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]ethanoate Openeye Name: ethyl 2-[2-bromo-6-ethoxy-4-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]phenoxy]acetate CAS Name: 2-[2-bromo-6-ethoxy-4-[(E)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-bromo-6-ethoxy-4-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]phenoxy]acetate Traditional Name: 2-[2-bromo-6-ethoxy-4-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]phenoxy]acetic acid ethyl ester Formula: C18H19BrN4O6 MolecularWeight: 467.27066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC2=NC=C(C=C2)[N+](=O)[O-])Br)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC2=NC=C(C=C2)[N+](=O)[O-])Br)OCC(=O)OCC

InChI

InChI=1S/C18H19BrN4O6/c1-3-27-15-8-12(7-14(19)18(15)29-11-17(24)28-4-2)9-21-22-16-6-5-13(10-20-16)23(25)26/h5-10H,3-4,11H2,1-2H3,(H,20,22)/b21-9+